cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2dr2stz
title: BindingDB Entry 3340: Design, synthesis and structure-activity relationships of 1,3,4-oxadiazole derivatives as novel inhibitors of glycogen synthase kinase-3beta.

description: Small molecule binding data for protein Cyclin-Dependent Kinase 1 (CDK1), Cyclin-Dependent Kinase 2 (CDK2), Cyclin-Dependent Kinase 5 (CDK5), Glycogen synthase kinase-3, Mitogen-activated protein kinase kinase kinase 1, and Protein kinase C theta type, Uniprot P06493, P14635, P20248, P24941, P49841, Q00535, Q04759, Q13233, and Q15078
DOI: 10.7270/q2fj2f26
title: BindingDB Entry 1984: Macrocyclic peptidomimetic inhibitors of beta-secretase (BACE): first X-ray structure of a macrocyclic peptidomimetic-BACE complex.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2gh9g61
title: BindingDB Entry 1966: New pyrrole inhibitors of monoamine oxidase: synthesis, biological evaluation, and structural determinants of MAO-A and MAO-B selectivity.

description: Small molecule binding data for protein Monoamine Oxidase Type A (MAO-A) and Monoamine Oxidase Type B (MAO-B), Uniprot P21398 and P56560
DOI: 10.7270/q2h70d7s
title: BindingDB Entry 4301: SAR analysis of small molecule antagonists of the kappa opioid receptor via a luminescent beta-arrestin assay

description: Small molecule binding data for protein Kappa-type opioid receptor, Uniprot P41145
DOI: 10.7270/q2j67fcm
title: BindingDB Entry 4292: Fluorescence polarization-based biochemical high throughput dose response assay for inhibitors of myeloid cell leukemia sequence 1 (MCL1) interactions with BIM-BH3 peptide.

description: Small molecule binding data for protein Induced myeloid leukemia cell differentiation protein Mcl-1, Uniprot Q07820
DOI: 10.7270/q2k935tz
title: BindingDB Entry 1983: Design, synthesis, and crystal structure of hydroxyethyl secondary amine-based peptidomimetic inhibitors of human beta-secretase.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2n014z3
title: BindingDB Entry 4300: SAR analysis of small molecule agonists of the kappa opioid receptor via a luminescent beta-arrestin assay

description: Small molecule binding data for protein Kappa-type opioid receptor, Uniprot P41145
DOI: 10.7270/q2n87841
title: BindingDB Entry 3350: In Vitro MKP-3 Dose Response Assay for SAR Study

description: Small molecule binding data for protein MKP-3, Uniprot Q64346
DOI: 10.7270/q2p8497z
title: BindingDB Entry 3337: Structure-Based Design, Synthesis, and Biological Evaluation of a Series of Novel and Reversible Inhibitors for the Severe Acute Respiratory Syndrome-Coronavirus Papain-Like Protease.

description: Small molecule binding data for protein SARS Coronavirus Coronavirus Papain-Like Protease
DOI: 10.7270/q2q23xhv
title: BindingDB Entry 1982: Application of Fragment Screening by X-ray Crystallography to beta-Secretase.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2rr1wp4
title: BindingDB Entry 4299: SAR analysis of NF-kB dependent luciferase using DAP as an inducer

description: Small molecule binding data for protein nucleotide-binding oligomerization domain containing 1, Uniprot Q9Y239
DOI: 10.7270/q2s180tw
title: BindingDB Entry 3349: High Throughput Screening Assay for Hsp70 Inhibitors

description: Small molecule binding data for protein Heat Shock 70kDa Protein 1
DOI: 10.7270/q2tt4p6t
title: BindingDB Entry 1981: Application of Fragment Screening by X-ray Crystallography to the Discovery of Aminopyridines as Inhibitors of beta-Secretase.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2wh2nf9
title: BindingDB Entry 4297: Fluorescence-based dose response cell-based high throughput screening assay to identify antagonists of the G-protein coupled receptor 7 (GPR7).

description: Small molecule binding data for protein neuropeptides B/W receptor 1, Uniprot P48145
DOI: 10.7270/q2wq0250
title: BindingDB Entry 3345: Synthesis and evaluation of imidazole-dioxolane compounds as selective heme oxygenase inhibitors: effect of substituents at the 4-position of the dioxolane ring.

description: Small molecule binding data for protein Cytochrome P450 2E1, Cytochrome P450 3A1, Heme Oxygenase 1 (HO-1), and Heme Oxygenase 2 (HO-2), Uniprot P04800, P05182, P06762, and P23711
DOI: 10.7270/q2xg9pk4
title: BindingDB Entry 4288: Fluorescence-based counterscreen for potentiators or agonists of NPY-Y2: cell-based high-throughput dose response assay for potentiators or agonists of NPY-Y1.

description: Small molecule binding data for protein Neuropeptide Y receptor type 1, Uniprot P25929
DOI: 10.7270/q2zg6qht
title: BindingDB Entry 1980: Design and Synthesis of 4-Azaindoles as Inhibitors of p38 MAP Kinase.

description: Small molecule binding data for protein Mitogen-activated protein kinase 14, Uniprot Q16539
DOI: 10.7270/q20863rr
title: BindingDB Entry 4305: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS7-Galphao for SAR Compounds

description: Small molecule binding data for protein RGS7, Uniprot P49802
DOI: 10.7270/q20g3hhh
title: BindingDB Entry 3359: Design of HIV-1 protease inhibitors with pyrrolidinones and oxazolidinones as novel P1 -ligands to enhance backbone-binding interactions with protease: synthesis, biological evaluation, and protein-ligand X-ray studies.

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q21c1v47
title: BindingDB Entry 2007: Identification of a small molecule nonpeptide active site beta-secretase inhibitor that displays a nontraditional binding mode for aspartyl proteases.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2416vg3
title: BindingDB Entry 4304: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS7-Galphao for SAR Compounds

description: Small molecule binding data for protein RGS7, Uniprot P49802
DOI: 10.7270/q247486s
title: BindingDB Entry 3357: Apogossypol derivatives as pan-active inhibitors of antiapoptotic B-cell lymphoma/leukemia-2 (Bcl-2) family proteins.

description: Small molecule binding data for protein Apoptosis regulator Bcl-2, Bcl-2-related protein A1, Bcl-xL/BAK, and Induced myeloid leukemia cell differentiation protein Mcl-1, Uniprot P10415, Q07817, Q07820, and Q16548
DOI: 10.7270/q2513wgp
title: BindingDB Entry 2006: Discovery of oxadiazoyl tertiary carbinamine inhibitors of beta-secretase (BACE-1).

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2610xkm
title: BindingDB Entry 1987: Novel factor Xa inhibitors based on a 2-carboxyindole scaffold: SAR of P4 substituents in combination with a neutral P1 ligand

description: Small molecule binding data for protein Coagulation factor X/antithrombin III and Prothrombin, Uniprot P00734 and P00742
DOI: 10.7270/q27p8wvp
title: BindingDB Entry 4303: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS4-Galphao for SAR compounds

description: Small molecule binding data for protein regulator of G-protein signaling 4, Uniprot P49798
DOI: 10.7270/q28050x3
title: BindingDB Entry 3356: One scaffold, three binding modes: novel and selective pteridine reductase 1 inhibitors derived from fragment hits discovered by virtual screening.

description: Small molecule binding data for protein Pteridine Reductase 1 (PTR1)
DOI: 10.7270/q28s4n5n
title: BindingDB Entry 2005: Conformationally biased P3 amide replacements of beta-secretase inhibitors.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2bg2mfk
title: BindingDB Entry 4310: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS19-Galphao for SAR Compounds

description: Small molecule binding data for protein G protein signalling regulator 19, Uniprot P49795
DOI: 10.7270/q2cf9njz
title: BindingDB Entry 4302: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS4-Galphao for SAR compounds

description: Small molecule binding data for protein regulator of G-protein signaling 4, Uniprot P49798
DOI: 10.7270/q2cr5rpk
title: BindingDB Entry 3352: Design, synthesis, and X-ray crystal structure of classical and nonclassical 2-amino-4-oxo-5-substituted-6-ethylthieno[2,3-d]pyrimidines as dual thymidylate synthase and dihydrofolate reductase inhibitors and as potential antitumor agents.

description: Small molecule binding data for protein Dihydrofolate Reductase (DHFR), Dihydrofolate reductase, Dihydrofolate reductase (DHFR), Thymidylate Synthase (TS), and Thymidylate synthase, Uniprot P00374, P04818, P0A884, P0ABQ4, and Q07422
DOI: 10.7270/q2dj5cwz
title: BindingDB Entry 2004: The structure of JNK3 in complex with small molecule inhibitors: structural basis for potency and selectivity.

description: Small molecule binding data for protein Mitogen-activated protein kinase 10 and Mitogen-activated protein kinase 14, Uniprot P53779 and Q16539
DOI: 10.7270/q2g73c4v
title: BindingDB Entry 4309: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS8-Galphao for SAR Compounds

description: Small molecule binding data for protein Regulator of G-protein signaling 8, Uniprot P57771
DOI: 10.7270/q2hh6hd9
title: BindingDB Entry 3351: Inhibition of the enzymatic activity of heme oxygenases by azole-based antifungal drugs.

description: Small molecule binding data for protein Heme Oxygenase 1 (HO-1) and Heme Oxygenase 2 (HO-2), Uniprot P06762 and P23711
DOI: 10.7270/q2j964n4
title: BindingDB Entry 2002: Discovery of a new class of 4-anilinopyrimidines as potent c-Jun N-terminal kinase inhibitors: Synthesis and SAR studies.

description: Small molecule binding data for protein c-Jun N-terminal kinase, JNK, Uniprot P45983
DOI: 10.7270/q2m043tq
title: BindingDB Entry 4308: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS8-Galphao for SAR Compounds

description: Small molecule binding data for protein Regulator of G-protein signaling 8, Uniprot P57771
DOI: 10.7270/q2m90706
title: BindingDB Entry 3362: A class of 2,4-bisanilinopyrimidine Aurora A inhibitors with unusually high selectivity against Aurora B.

description: Small molecule binding data for protein Aurora kinase B/Inner centromere protein and Serine/threonine-protein kinase Aurora, Uniprot O14965 and Q96GD4
DOI: 10.7270/q2p26wdx
title: BindingDB Entry 1994: Aminopyridine-based c-Jun N-terminal kinase inhibitors with cellular activity and minimal cross-kinase activity.

description: Small molecule binding data for protein Mitogen-activated protein kinase 10, Mitogen-activated protein kinase 9, and c-Jun N-terminal kinase, JNK, Uniprot P45983, P45984, and P53779
DOI: 10.7270/q2qr4vjr
title: BindingDB Entry 4307: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS16-Galphao for SAR Compounds

description: Small molecule binding data for protein regulator of G-protein signalling 16, Uniprot O15492
DOI: 10.7270/q2r20zq4
title: BindingDB Entry 3361: Structural insights into how irreversible inhibitors can overcome drug resistance in EGFR.

description: Small molecule binding data for protein EGF-R Tyrosine Kinase, EGF-R Tyrosine Kinase Mutant (T790M), Src Mutant (S345C), and Src Mutant (S345C/T338M)
DOI: 10.7270/q2st7n3w
title: BindingDB Entry 1992: Discovery of potent, highly selective, and orally bioavailable pyridine carboxamide c-Jun NH2-terminal kinase inhibitors.

description: Small molecule binding data for protein Mitogen-activated protein kinase 9 and c-Jun N-terminal kinase, JNK, Uniprot P45983 and P45984
DOI: 10.7270/q2vh5m8g
title: BindingDB Entry 4306: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS16-Galphao for SAR Compounds

description: Small molecule binding data for protein regulator of G-protein signalling 16, Uniprot O15492
DOI: 10.7270/q2vt1qd3
title: BindingDB Entry 3360: Hybrid compound design to overcome the gatekeeper T338M mutation in cSrc.

description: Small molecule binding data for protein Src and Src Mutant (T338M), Uniprot P00523
DOI: 10.7270/q2xk8csr
title: BindingDB Entry 1990: Synthesis and SAR of 1,9-dihydro-9-hydroxypyrazolo[3,4-b]quinolin-4-ones as novel, selective c-Jun N-terminal kinase inhibitors.

description: Small molecule binding data for protein Mitogen-activated protein kinase 9 and c-Jun N-terminal kinase, JNK, Uniprot P45983 and P45984
DOI: 10.7270/q20c4t2r
title: BindingDB Entry 2025: Characterization of the antitumor effects of the selective farnesyl protein transferase inhibitor R115777 in vivo and in vitro.

description: Small molecule binding data for protein Geranylgeranyl Transferase (GGTase-I) and Protein Farnesyltransferase (PFT), Uniprot P49354 and P49356
DOI: 10.7270/q2319tbq
title: BindingDB Entry 4312: Late stage fluorescence dose response cell-based screening assay for antagonists of the Sphingosine 1-Phosphate Receptor 4 (S1P4)

description: Small molecule binding data for protein Sphingosine 1-Phosphate Receptor 4, Uniprot O95977
DOI: 10.7270/q23b5xgb
title: BindingDB Entry 3368: A structure-based approach to ligand discovery for 2C-methyl-D-erythritol-2,4-cyclodiphosphate synthase: a target for antimicrobial therapy.

description: Small molecule binding data for protein 2C-methyl-D-erythritol-2,4-cyclodiphosphate synthase (IspF), Uniprot P62617
DOI: 10.7270/q2445jrm
title: BindingDB Entry 2023: Crystals of the urokinase type plasminogen activator variant beta(c)-uPAin complex with small molecule inhibitors open the way towards structure-based drug design.

description: Small molecule binding data for protein Tissue-type plasminogen activator, Trypsin, and Urokinase-type plasminogen activator, Uniprot P00749, P00750, and P00760
DOI: 10.7270/q26t0k2p
title: BindingDB Entry 4311: Dose response, multiplexed high-throughput screen for small molecule regulators of RGS family protein interactions, specifically RGS19-Galphao for SAR Compounds

description: Small molecule binding data for protein G protein signalling regulator 19, Uniprot P49795
DOI: 10.7270/q2707zsb
title: BindingDB Entry 3366: Pyrano[3,2-c]quinoline-6-chlorotacrine hybrids as a novel family of acetylcholinesterase- and beta-amyloid-directed anti-Alzheimer compounds.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P06276, P22303, and P23795
DOI: 10.7270/q27s7m18
title: BindingDB Entry 2017: Selective Urokinase-Type Plasminogen Activator Inhibitors. 4. 1-(7-Sulfonamidoisoquinolinyl)guanidines.

description: Small molecule binding data for protein Plasminogen, Tissue-type plasminogen activator, and Urokinase-type plasminogen activator, Uniprot P00747, P00749, and P00750
DOI: 10.7270/q29k48p2
title: BindingDB Entry 4318: Late stage fluorescence dose response cell-based screening assay for antagonists of the Sphingosine 1-Phosphate Receptor 4 (S1P4): Synthesized analogues

description: Small molecule binding data for protein Sphingosine 1-Phosphate Receptor 4, Uniprot O95977
DOI: 10.7270/q2br8qhr
title: BindingDB Entry 3365: Structural basis for isotype selectivity of the human retinoic acid nuclear receptor.

description: Small molecule binding data for protein Retinoic Acid Receptor, alpha, Retinoic Acid Receptor, beta, and Retinoic Acid Receptor, gamma
DOI: 10.7270/q2cj8bq4
title: BindingDB Entry 2016: Biphenyl-4-ylcarbamoyl thiophene carboxylic acids as potent DHODH inhibitors.

description: Small molecule binding data for protein Dihydroorotate Dehydrogenase (DHODH)
DOI: 10.7270/q2fb51cb
title: BindingDB Entry 4317: HTS Image-Based Screen for Agonists of the DOR Receptor

description: Small molecule binding data for protein Delta-type opioid receptor, Uniprot P41143
DOI: 10.7270/q2gh9g8x
title: BindingDB Entry 3364: Structural insight into the inhibition of human kynurenine aminotransferase I/glutamine transaminase K.

description: Small molecule binding data for protein Kynurenine Aminotransferase 1/Glutamine Transaminase K, Uniprot Q16773
DOI: 10.7270/q2h993fv
title: BindingDB Entry 2015: Brequinar derivatives and species-specific drug design for dihydroorotate dehydrogenase.

description: Small molecule binding data for protein Dihydroorotate dehydrogenase, Uniprot Q02127
DOI: 10.7270/q2k072qs
title: BindingDB Entry 4316: SAR analysis of Antagonists of the GPR35 Receptor using an Image-Based Assay

description: Small molecule binding data for protein G-protein coupled receptor 35, Uniprot Q9HC97
DOI: 10.7270/q2n29v6n
title: BindingDB Entry 2014: The first de novo designed inhibitors of Plasmodium falciparum dihydroorotate dehydrogenase.

description: Small molecule binding data for protein Dihydroorotate Dehydrogenase (DHODH) and Dihydroorotate dehydrogenase, Uniprot Q02127 and Q08210
DOI: 10.7270/q2pr7tdc
title: BindingDB Entry 4315: SAR analysis of inhibitors of TNFa specific NF-kB induction revised

description: Small molecule binding data for protein Tumor necrosis factor (TNF-alpha), Uniprot P01375
DOI: 10.7270/q2qv3jst
title: BindingDB Entry 2028: Identification of Inhibitors of Protein Kinase B Using Fragment-Based Lead Discovery.

description: Small molecule binding data for protein Serine/threonine-protein kinase AKT, Uniprot P31751
DOI: 10.7270/q2rv0kzn
title: BindingDB Entry 2010: Structure-based design and synthesis of macroheterocyclic peptidomimetic inhibitors of the aspartic protease beta-site amyloid precursor protein cleaving enzyme (BACE).

description: Small molecule binding data for protein Cathepsin D and beta-Secretase (BACE-1), Uniprot P07339
DOI: 10.7270/q2th8k43
title: BindingDB Entry 4314: SAR analysis of compounds that inhibit NOD2 revised

description: Small molecule binding data for protein nucleotide-binding oligomerization domain containing 2, Uniprot Q9HC29
DOI: 10.7270/q2tt4pbm
title: BindingDB Entry 3371: Dipeptidyl nitrile inhibitors of Cathepsin L.

description: Small molecule binding data for protein Cathepsin (B and K), Cathepsin K, Cathepsin L, Cathepsin S, and Cathepsin V, Uniprot O60911, P07858, P25774, and P43235
DOI: 10.7270/q2wm1bpc
title: BindingDB Entry 2008: Structure-based design, synthesis, and memapsin 2 (BACE) inhibitory activity of carbocyclic and heterocyclic peptidomimetics.

description: Small molecule binding data for protein Cathepsin D and beta-Secretase (BACE-1), Uniprot P07339
DOI: 10.7270/q2z899vd
title: BindingDB Entry 4313: SAR analysis of compounds that inhibit NOD1 revised

description: Small molecule binding data for protein nucleotide-binding oligomerization domain containing 1, Uniprot Q9Y239
DOI: 10.7270/q2zk5f1w
title: BindingDB Entry 3369: Discovering potent inhibitors against the beta-hydroxyacyl-acyl carrier protein dehydratase (FabZ) of Helicobacter pylori: structure-based design, synthesis, bioassay, and crystal structure determination.

description: Small molecule binding data for protein beta-Hydroxyacyl-Acyl Carrier Protein Dehydratase (FabZ), Uniprot O25928
DOI: 10.7270/q2125r3z
title: BindingDB Entry 4328: SAR Analysis of Agonists of the DOR Receptor using an Image-Based Assay

description: Small molecule binding data for protein Delta-type opioid receptor, Uniprot P41143
DOI: 10.7270/q2222s7b
title: BindingDB Entry 4320: Late stage counterscreen assay for S1P4 antagonists: Fluorescence dose response cell-based screening assay for antagonists of the Sphingosine 1-Phosphate Receptor 3 (S1P3)

description: Small molecule binding data for protein Sphingosine 1-phosphate receptor 3, Uniprot Q99500
DOI: 10.7270/q22b8wcd
title: BindingDB Entry 3383: Improving potency and selectivity of a new class of non-Zn-chelating MMP-13 inhibitors.

description: Small molecule binding data for protein Collagenase, Uniprot P45452
DOI: 10.7270/q2348hnp
title: BindingDB Entry 2034: Design, Synthesis, and X-ray Structure of Potent Memapsin 2 (beta-Secretase) Inhibitors with Isophthalamide Derivatives as the P2-P3 Ligands.

description: Small molecule binding data for protein Beta-secretase 1, Beta-secretase 2 (BACE2), and Cathepsin D, Uniprot P07339, P56817, and Q9Y5Z0
DOI: 10.7270/q24t6gtz
title: BindingDB Entry 4327: SAR analysis of Agonists of the Kappa Opioid Receptor (KOR) using an Image-Based Assay

description: Small molecule binding data for protein Kappa-type opioid receptor, Uniprot P41145
DOI: 10.7270/q25t3hzb
title: BindingDB Entry 4319: SAR analysis of Antagonists of the Kappa Opioid Receptor (KOR) using an Image-Based Assay

description: Small molecule binding data for protein Kappa-type opioid receptor, Uniprot P41145
DOI: 10.7270/q2639n2p
title: BindingDB Entry 3380: Achiral oligoamines as versatile tool for the development of aspartic protease inhibitors.

description: Small molecule binding data for protein HIV-1 Protease, Pepsin A, Plasmepsin 2, Plasmepsin IV, Renin, and beta-Secretase (BACE-1), Uniprot P00791, P00797, and P46925
DOI: 10.7270/q26w98bn
title: BindingDB Entry 2033: Design, synthesis and X-ray structure of protein-ligand complexes: important insight into selectivity of memapsin 2 (beta-secretase) inhibitors.

description: Small molecule binding data for protein Beta-secretase 1, Beta-secretase 2 (BACE2), and Cathepsin D, Uniprot P07339, P56817, and Q9Y5Z0
DOI: 10.7270/q29s1pdc
title: BindingDB Entry 3379: Novel adenosine-derived inhibitors of 70 kDa heat shock protein, discovered through structure-based design.

description: Small molecule binding data for protein Heat Shock 70kDa Protein 1, Uniprot P0DMV8,P0DMV9
DOI: 10.7270/q2bk19mr
title: BindingDB Entry 2032: Evidence for a novel binding site conformer of aldose reductase in ligand-bound state.

description: Small molecule binding data for protein Aldose reductase (AR), Uniprot P15121
DOI: 10.7270/q2db808d
title: BindingDB Entry 4325: HTS Image-Based Screen for Antagonists of the DOR Receptor

description: Small molecule binding data for protein Delta-type opioid receptor, Uniprot P41143
DOI: 10.7270/q2fj2f43
title: BindingDB Entry 3378: Fluorescence polarization assay for PKD inhibitiors-IC50 determinations

description: Small molecule binding data for protein Serine/threonine-protein kinase D1, Uniprot Q15139
DOI: 10.7270/q2gb2291
title: BindingDB Entry 2030: Structural and thermodynamic study on aldose reductase: nitro-substituted inhibitors with strong enthalpic binding contribution.

description: Small molecule binding data for protein Aldose reductase (AR), Uniprot P15121
DOI: 10.7270/q2j38qzw
title: BindingDB Entry 4324: Late stage counterscreen assay for S1P4 antagonists: Fluorescence dose response cell-based screening assay for antagonists of the Sphingosine 1-Phosphate Receptor 2 (S1P2)

description: Small molecule binding data for protein Sphingosine 1-Phosphate Receptor 2, Uniprot O95136
DOI: 10.7270/q2k35rwk
title: BindingDB Entry 2038: High affinity InhA inhibitors with activity against drug-resistant strains of Mycobacterium tuberculosis.

description: Small molecule binding data for protein Enoyl-ACP Reductase (InhA), Uniprot P9WGR1
DOI: 10.7270/q2k935wv
title: BindingDB Entry 3377: Multiplexed dose response screen for small molecule regulators of Bcl-2 family protein interactions, specifically Bim-Bcl-XL.

description: Small molecule binding data for protein Apoptosis Regulator Bcl-xL
DOI: 10.7270/q2m32t1c
title: BindingDB Entry 2029: Rapid Evolution of 6-Phenylpurine Inhibitors of Protein Kinase B through Structure-Based Design.

description: Small molecule binding data for protein Serine/threonine-protein kinase AKT and cAMP-Dependent Protein Kinase (PKA), Uniprot P00517 and P31751
DOI: 10.7270/q2ns0sbf
title: BindingDB Entry 4323: SAR Analysis of Agonists of the MOR Receptor using an Image-Based Assay

description: Small molecule binding data for protein Mu-type opioid receptor, Uniprot P35372