cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2qr51ts
title: BindingDB Entry 50012973: Simultaneous Inhibition of SIRT2 Deacetylase and Defatty-Acylase Activities via a PROTAC Strategy.

description: Small molecule binding data for protein NAD-dependent protein deacetylase sirtuin-1, NAD-dependent protein deacetylase sirtuin-2, NAD-dependent protein deacetylase sirtuin-3, mitochondrial, NAD-dependent protein deacylase sirtuin-5, mitochondrial, and NAD-dependent protein deacylase sirtuin-6, Uniprot Q8IXJ6, Q8N6T7, Q96EB6, Q9NTG7, and Q9NXA8
DOI: 10.7270/q2qr51v7
title: BindingDB Entry 50013639: Discovery of macrocyclic HDACs 1, 2, and 3 selective inhibitors for HIV latency reactivation.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 2, Histone deacetylase 3, Histone deacetylase 6, and Histone deacetylase 8, Uniprot O15379, Q13547, Q92769, Q9BY41, and Q9UBN7
DOI: 10.7270/q2qr51wp
title: BindingDB Entry 50013973: Synthesis, optimization, in vitro and in vivo study of bicyclic substituted amine as MenA inhibitor.

description: Small molecule binding data for protein 1,4-dihydroxy-2-naphthoate octaprenyltransferase, Uniprot P9WIP3
DOI: 10.7270/q2qr51x4
title: BindingDB Entry 50014273: Novel Compounds as PHD Inhibitors for Treating Heart, Lung, Liver, and Kidney Diseases.

description: Small molecule binding data for protein Egl nine homolog 1, Prolyl hydroxylase EGLN2, and Prolyl hydroxylase EGLN3, Uniprot Q96KS0, Q9GZT9, and Q9H6Z9
DOI: 10.7270/q2qr51zk
title: BindingDB Entry 50014631: Design, Synthesis, and Pharmacological Evaluation of Biaryl-Containing PD-1/PD-L1 Interaction Inhibitors Bearing a Unique Difluoromethyleneoxy Linkage.

description: Small molecule binding data for protein Programmed cell death 1 ligand/protein 1, Uniprot Q15116 and Q9NZQ7
DOI: 10.7270/q2qv3qjr
title: BindingDB Entry 9048: Aza-heteroaryl compounds as PI3K-gamma inhibitors

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Uniprot O00329 and P48736
DOI: 10.7270/q2qv3qk6
title: BindingDB Entry 9435: Use of agonists of formyl peptide receptor 2 for treating dermatological diseases

description: Small molecule binding data for protein N-formyl peptide receptor 2, Uniprot P25090
DOI: 10.7270/q2qv3qmn
title: BindingDB Entry 9822: 6-aminopyridin-3-yl pyrazoles as modulators of RORgT

description: Small molecule binding data for protein Nuclear receptor ROR-gamma, Uniprot P51449
DOI: 10.7270/q2qv3qn3
title: BindingDB Entry 10031: Small molecule inhibitors of Galectin-3

description: Small molecule binding data for protein Galectin-3, Uniprot P17931
DOI: 10.7270/q2qv3qpj
title: BindingDB Entry 10209: Calcium channel inhibitors

description: Small molecule binding data for protein Cytochrome P450 2D6 and Cytochrome P450 3A4, Uniprot P08684 and P10635
DOI: 10.7270/q2qv3qq0
title: BindingDB Entry 10418: PHOSPHOLIPID COMPOUNDS AND USES THEREOF

description: Small molecule binding data for protein Fusion glycoprotein F0 and Replicase polyprotein 1ab, Uniprot P03420 and P0DTD1
DOI: 10.7270/q2qv3qrf
title: BindingDB Entry 10805: TYK2 inhibitors and uses thereof

description: Small molecule binding data for protein Non-receptor tyrosine-protein kinase TYK2 and Tyrosine-protein kinase JAK2, Uniprot O60674 and P29597
DOI: 10.7270/q2qv3qsw
title: BindingDB Entry 50007046: Opioids as Substrates and Inhibitors of the Genetically Highly Variable Organic Cation Transporter OCT1.

description: Small molecule binding data for protein Solute carrier family 22 member 1, Uniprot O15245
DOI: 10.7270/q2qv3qtb
title: BindingDB Entry 50007656: Single Nucleotide Polymorphisms in the Melanocortin His-Phe-Arg-Trp Sequences Decrease Tetrapeptide Potency and Efficacy.

description: Small molecule binding data for protein Melanocortin receptor 3, Melanocortin receptor 4, Melanocortin receptor 5, and Melanocyte-stimulating hormone receptor, Uniprot P33033, P41149, P56450, and Q01727
DOI: 10.7270/q2qv3qvs
title: BindingDB Entry 50007976: Design, Synthesis, and Biological Evaluation of Imidazo[1,2-

description: Small molecule binding data for protein Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, and Serine/threonine-protein kinase mTOR, Uniprot O00329, P27986, P42336, P42338, P42345, and P48736
DOI: 10.7270/q2qv3qw7
title: BindingDB Entry 50008265: Divalent cannabinoid-1 receptor ligands: A linker attachment point survey of SR141716A for development of high-affinity CB1R molecular probes.

description: Small molecule binding data for protein Cannabinoid receptor 1 and D(2) dopamine receptor, Uniprot P14416 and P21554
DOI: 10.7270/q2qv3qxp
title: BindingDB Entry 50008594: Discovery, cocrystallization and biological evaluation of novel piperidine derivatives as high affinity Ls-AChBP ligands possessing α7 nAChR activities.

description: Small molecule binding data for protein Acetylcholine-binding protein and Neuronal acetylcholine receptor subunit alpha-7, Uniprot P36544 and P58154
DOI: 10.7270/q2qv3qz4
title: BindingDB Entry 50008914: Topographical Mapping of Isoform-Selectivity Determinants for J-Channel-Binding Inhibitors of Sphingosine Kinases 1 and 2.

description: Small molecule binding data for protein Sphingosine kinase 1 and Sphingosine kinase 2, Uniprot Q9NRA0 and Q9NYA1
DOI: 10.7270/q2qv3r00
title: BindingDB Entry 50009243: The discovery of quinoline-3-carboxamides as hematopoietic prostaglandin D synthase (H-PGDS) inhibitors.

description: Small molecule binding data for protein Hematopoietic prostaglandin D synthase, Uniprot O35543 and O60760
DOI: 10.7270/q2qv3r1f
title: BindingDB Entry 50009854: Discovery and Structural Optimization of N5-Substituted 6,7-Dioxo-6,7-dihydropteridines as Potent and Selective Epidermal Growth Factor Receptor (EGFR) Inhibitors against L858R/T790M Resistance Mutation.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q2qv3r2w
title: BindingDB Entry 50010429: Synthesis of natural product-like polyprenylated phenols and quinones: Evaluation of their neuroprotective activities.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] B, Uniprot P27338
DOI: 10.7270/q2qv3r3b
title: BindingDB Entry 50011052: Highly Potent and Selective

description: Small molecule binding data for protein 6-pyruvoyl tetrahydrobiopterin synthase, Dual specificity protein phosphatase 10, Dual specificity protein phosphatase 3, Dual specificity protein phosphatase 6, Dual specificity protein phosphatase CDC14A, Laforin, Low molecular weight protein-tyrosine phosphatase A, Receptor-type tyrosine-protein phosphatase C, Receptor-type tyrosine-protein phosphatase beta, Receptor-type tyrosine-protein phosphatase epsilon, Receptor-type tyrosine-protein phosphatase eta, Receptor-type tyrosine-protein phosphatase gamma, Receptor-type tyrosine-protein phosphatase mu, Serine/threonine-protein phosphatase 2A activator, TYR_PHOSPHATASE_2 domain-containing protein, Tyrosine-protein phosphatase non-receptor type 1, Tyrosine-protein phosphatase non-receptor type 11, Tyrosine-protein phosphatase non-receptor type 12, Tyrosine-protein phosphatase non-receptor type 13, Tyrosine-protein phosphatase non-receptor type 2, Tyrosine-protein phosphatase non-receptor type 22, Tyrosine-protein phosphatase non-receptor type 5, Tyrosine-protein phosphatase non-receptor type 6, Tyrosine-protein phosphatase non-receptor type 7, and Tyrosine-protein phosphatase non-receptor type 9, Uniprot O95278, P08575, P17706, P18031, P23467, P23469, P23470, P28827, P29350, P35236, P43378, P51452, P54829, P96830, P9WIA1, Q03393, Q05209, Q06124, Q12913, Q12923, Q15257, Q16828, Q9UNH5, Q9Y2R2, and Q9Y6W6
DOI: 10.7270/q2qv3r4s
title: BindingDB Entry 50011387: Optimization of linear and cyclic peptide inhibitors of KEAP1-NRF2 protein-protein interaction.

description: Small molecule binding data for protein Kelch-like ECH-associated protein 1, Uniprot Q14145
DOI: 10.7270/q2qv3r57
title: BindingDB Entry 50011674: Novel Galectin-3 Inhibitors for Treating Fibrosis.

description: Small molecule binding data for protein Galectin-3, Uniprot P17931
DOI: 10.7270/q2qv3r6p
title: BindingDB Entry 50012027: Hydroxy-

description: Small molecule binding data for protein Tyrosine-protein phosphatase non-receptor type 1, Uniprot P18031
DOI: 10.7270/q2qv3r74
title: BindingDB Entry 50012645: Sulfonamide/sulfamate switch with a series of piperazinylureido derivatives: Synthesis, kinetic and in silico evaluation as carbonic anhydrase isoforms I, II, IV, and IX inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase 1, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot P00915, P00918, and Q16790
DOI: 10.7270/q2qv3r8k
title: BindingDB Entry 50013283: Identification and development of non-cytotoxic cell death modulators: Impact of sartans and derivatives on PPARγ activation and on growth of imatinib-resistant chronic myelogenous leukemia cells.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor gamma, Uniprot P37231
DOI: 10.7270/q2qv3r91
title: BindingDB Entry 50013921: A biphenyl inhibitor of eIF4E targeting an internal binding site enables the design of cell-permeable PROTAC-degraders.

description: Small molecule binding data for protein Eukaryotic translation initiation factor 4E and Protein cereblon, Uniprot P06730 and Q96SW2
DOI: 10.7270/q2qv3rbg
title: BindingDB Entry 50014587: Ugi Reaction Synthesis of Oxindole-Lactam Hybrids as Selective Butyrylcholinesterase Inhibitors.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot O42275 and P81908
DOI: 10.5281/zenodo.7677231
title: Table 4. The average percentage of wound healing on day 5, 10 And 15 of the control, comparison and 10% of subfraction ethyl acetate ointment from Meniran leaves

description: Table 4. The average percentage of wound healing on day 5, 10 And 15 of the control, comparison and 10% of subfraction ethyl acetate ointment from Meniran leaves
DOI: 10.5281/zenodo.7677230
title: Table 4. The average percentage of wound healing on day 5, 10 And 15 of the control, comparison and 10% of subfraction ethyl acetate ointment from Meniran leaves

description: Table 4. The average percentage of wound healing on day 5, 10 And 15 of the control, comparison and 10% of subfraction ethyl acetate ointment from Meniran leaves
DOI: 10.7270/q2qz2f1c
title: BindingDB Entry 9226: Quinazolines as potassium ion channel inhibitors

description: Small molecule binding data for protein Angiopoietin-1 receptor, Aurora kinase A, Aurora kinase B, Casein kinase I isoform alpha, Casein kinase II subunit alpha, Casein kinase II subunit alpha', Cyclin-dependent kinase 2, Cyclin-dependent kinase 5 activator 1, Cyclin-dependent kinase 5 activator 1 [99-307], Cytoplasmic tyrosine-protein kinase BMX, Glycogen synthase kinase-3 beta, Inhibitor of nuclear factor kappa-B kinase subunit epsilon, Insulin-like growth factor 1 receptor, Interleukin-1 receptor-associated kinase 1, Interleukin-1 receptor-associated kinase 4, Mitogen-activated protein kinase kinase kinase 8, Non-receptor tyrosine-protein kinase TYK2, Nuclear receptor subfamily 2 group C member 2, Proto-oncogene tyrosine-protein kinase Src, Serine/threonine-protein kinase PLK1, Serine/threonine-protein kinase TBK1, Serine/threonine-protein kinase pim-1, Tyrosine-protein kinase BTK, Tyrosine-protein kinase ITK/TSK, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, Tyrosine-protein kinase JAK3, Tyrosine-protein kinase Lck, Tyrosine-protein kinase Lyn, Tyrosine-protein kinase TXK, and Vascular endothelial growth factor receptor 3, Uniprot O60674, P06239, P07948, P08069, P11309, P12931, P19784, P23458, P24941, P29597, P35916, P41279, P42681, P48729, P49116, P49841, P51617, P51813, P52333, P53350, P68400, P97477, Q02763, Q06187, Q08881, Q14164, Q15078, Q96GD4, Q9NWZ3, and Q9UHD2
DOI: 10.7270/q2qz2f2t
title: BindingDB Entry 9613: Inhibitors of cyclin-dependent kinase 7 (CDK7)

description: Small molecule binding data for protein CDK-activating kinase assembly factor MAT1/Cyclin-H/Cyclin-dependent kinase 7, Cyclin-A2/Cyclin-dependent kinase 2, Cyclin-K/Cyclin-dependent kinase 9, Homeodomain-interacting protein kinase 4, Maternal embryonic leucine zipper kinase, Protein kinase C theta type, Proto-oncogene tyrosine-protein kinase Src, Proto-oncogene tyrosine-protein kinase receptor Ret, Serine/threonine-protein kinase Chk2, and Tyrosine-protein kinase Fgr, Uniprot O75909, O96017, P07949, P09769, P12931, P20248, P24941, P50613, P50750, P51946, P51948, Q04759, Q14680, and Q8NE63
DOI: 10.7270/q2qz2f38
title: BindingDB Entry 10000: Aminopyrazine derivatives as PI3K-γ inhibitors

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Uniprot O00329 and P48736
DOI: 10.7270/q2qz2f4q
title: BindingDB Entry 10387: Linear glycosidase inhibitors

description: Small molecule binding data for protein Protein O-GlcNAcase, Uniprot O60502
DOI: 10.7270/q2qz2f55
title: BindingDB Entry 10596: Inhibitors of Bruton's tyrosine kinase and methods of their use

description: Small molecule binding data for protein Tyrosine-protein kinase BTK, Uniprot Q06187
DOI: 10.7270/q2qz2f6m
title: BindingDB Entry 10774: Aryl and heteroaryl substituted indole compounds

description: Small molecule binding data for protein Toll-like receptor 7, Toll-like receptor 8, and Toll-like receptor 9, Uniprot Q9NR96, Q9NR97, and Q9NYK1
DOI: 10.7270/q2qz2f72
title: BindingDB Entry 50006721: Modulators of KEAP-1 Activity as Potential Therapies for the Treatment of Neurodegenerative Disorders.

description: Small molecule binding data for protein Kelch-like ECH-associated protein 1, Uniprot Q14145
DOI: 10.7270/q2qz2f8h
title: BindingDB Entry 50007310: Discovery of Novel Pyruvate Dehydrogenase Kinase 4 Inhibitors for Potential Oral Treatment of Metabolic Diseases.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4/3A43/3A5/3A7, UDP-glucuronosyltransferase 1A1, UDP-glucuronosyltransferase 1A4, UDP-glucuronosyltransferase 1A9, UDP-glucuronosyltransferase 2B7, and [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial, Uniprot O60656, P05177, P08684, P10635, P11712, P16662, P20815, P22309, P22310, P24462, P33261, Q16654, and Q9HB55
DOI: 10.7270/q2qz2f9z
title: BindingDB Entry 50007932: The Immunoproteasome: An Emerging Target in Cancer and Autoimmune and Neurological Disorders.

description: Small molecule binding data for protein Proteasome subunit beta type-8, Uniprot P28062
DOI: 10.7270/q2qz2fbd
title: BindingDB Entry 50008533: Systematic Investigation of Lipophilicity Modulation by Aliphatic Fluorination Motifs.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Uniprot P40989
DOI: 10.7270/q2qz2fcv
title: BindingDB Entry 50009192: Plasma kallikrein cleaves and inactivates apelin-17: Palmitoyl- and PEG-extended apelin-17 analogs as metabolically stable blood pressure-lowering agents.

description: Small molecule binding data for protein Apelin receptor, Uniprot P35414 and Q9JHG3
DOI: 10.7270/q2qz2fd9
title: BindingDB Entry 50009531: Triterpenoid Hydroxamates as HIF Prolyl Hydrolase Inhibitors.

description: Small molecule binding data for protein Egl nine homolog 1/Prolyl hydroxylase EGLN2/Prolyl hydroxylase EGLN3/Transmembrane prolyl 4-hydroxylase, Uniprot Q96KS0, Q9GZT9, Q9H6Z9, and Q9NXG6
DOI: 10.7270/q2qz2ffr
title: BindingDB Entry 50009816: Structure-Based Design of Potent Nicotinamide Phosphoribosyltransferase Inhibitors with Promising in Vitro and in Vivo Antitumor Activities.

description: Small molecule binding data for protein Nicotinamide phosphoribosyltransferase, Uniprot P43490
DOI: 10.7270/q2qz2fg6
title: BindingDB Entry 50010131: Novel Phenyldiazenyl Fibrate Analogues as PPAR α/γ/δ Pan-Agonists for the Amelioration of Metabolic Syndrome.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor delta, and Peroxisome proliferator-activated receptor gamma, Uniprot P37231, Q03181, and Q07869
DOI: 10.7270/q2qz2fhn
title: BindingDB Entry 50010709: The Medicinal Chemistry in the Era of Machines and Automation: Recent Advances in Continuous Flow Technology.

description: Small molecule binding data for protein Albumin, Alpha-1B adrenergic receptor, and Beta-secretase 1, Uniprot P02768, P35368, and P56817
DOI: 10.7270/q2qz2fj3
title: BindingDB Entry 50011341: Di-bromo-Based Small-Molecule Inhibitors of the PD-1/PD-L1 Immune Checkpoint.

description: Small molecule binding data for protein Programmed cell death 1 ligand/protein 1, Uniprot Q15116 and Q9NZQ7
DOI: 10.7270/q2qz2fkj
title: BindingDB Entry 50011980: Discovery of Orally Active and Nonsteroidal Farnesoid X Receptor (FXR) Antagonist with Propensity for Accumulation and Responsiveness in Ileum.

description: Small molecule binding data for protein Bile acid receptor, Uniprot Q96RI1
DOI: 10.7270/q2qz2fm0
title: BindingDB Entry 50012295: 4-Amino-1,2,4-triazole-3-thione-derived Schiff bases as metallo-β-lactamase inhibitors.

description: Small molecule binding data for protein Lactoylglutathione lyase, Uniprot Q04760
DOI: 10.7270/q2qz2fnf
title: BindingDB Entry 50012596: Hit-to-Lead Optimization of Mouse Trace Amine Associated Receptor 1 (mTAAR1) Agonists with a Diphenylmethane-Scaffold: Design, Synthesis, and Biological Study.

description: Small molecule binding data for protein Trace amine-associated receptor 1, Uniprot Q923Y8
DOI: 10.7270/q2qz2fpw
title: BindingDB Entry 50012925: Mechanism-Based Design of 3-Amino-4-Halocyclopentenecarboxylic Acids as Inactivators of GABA Aminotransferase.

description: Small molecule binding data for protein 4-aminobutyrate aminotransferase, mitochondrial and Ornithine aminotransferase, mitochondrial, Uniprot P04181 and P80147
DOI: 10.7270/q2qz2fqb
title: BindingDB Entry 50013230: Identification of (R)-N-((4-Methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-2-methyl-1-(1-(1-(2,2,2-trifluoroethyl)piperidin-4-yl)ethyl)-1H-indole-3-carboxamide (CPI-1205), a Potent and Selective Inhibitor of Histone Methyltransferase EZH2, Suitable for Phase I Clinical Trials for B-Cell Lymp

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Histone-lysine N-methyltransferase EZH1, and Histone-lysine N-methyltransferase EZH2, Uniprot P40989, Q15910, and Q92800
DOI: 10.7270/q2qz2frs
title: BindingDB Entry 50013565: Design, synthesis, biological evaluation and structure-activity relationship study of quinazolin-4(3H)-one derivatives as novel USP7 inhibitors.

description: Small molecule binding data for protein Ubiquitin carboxyl-terminal hydrolase 7, Uniprot Q93009
DOI: 10.7270/q2qz2fs7
title: BindingDB Entry 50014235: Discovery and

description: Small molecule binding data for protein Cathepsin B, Cathepsin K, Cathepsin S, Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Dipeptidyl peptidase 1, and Procathepsin L, Uniprot P05177, P07711, P07858, P08684, P10635, P11712, P25774, P33261, P43235, and P53634
DOI: 10.7270/q2r214dj
title: BindingDB Entry 9195: Piperidin-4-yl azetidine derivatives as JAK1 inhibitors

description: Small molecule binding data for protein Tyrosine-protein kinase JAK1 [837-1142] and Tyrosine-protein kinase JAK2 [828-1132], Uniprot O60674 and P23458
DOI: 10.7270/q2r214f0
title: BindingDB Entry 9404: Spiro-fused cyclic ureas as inhibitors of rock

description: Small molecule binding data for protein Rho-associated protein kinase 2, Uniprot O75116
DOI: 10.7270/q2r214gf
title: BindingDB Entry 9582: Dab2 inhibitors for the prevention and treatment of cystic fibrosis

description: Small molecule binding data for protein Disabled homolog 2, Uniprot P98082
DOI: 10.7270/q2r214hw
title: BindingDB Entry 9791: Oxazole derivatives for use in the treatment of cancer

description: Small molecule binding data for protein Bifunctional phosphoribosylaminoimidazole carboxylase/phosphoribosylaminoimidazole succinocarboxamide synthetase, Uniprot P22234
DOI: 10.7270/q2r214jb
title: BindingDB Entry 10178: L,2-dihydro-3H-pyrazolo[3,4-D]pyrimidin-3-one analogs

description: Small molecule binding data for protein Wee1-like protein kinase, Uniprot P30291
DOI: 10.7270/q2r214ks
title: BindingDB Entry 10565: Inhibiting mutant isocitrate dehydrogenase 1 (mIDH-1)

description: Small molecule binding data for protein Isocitrate dehydrogenase [NADP] cytoplasmic [R132C] and Isocitrate dehydrogenase [NADP] cytoplasmic [R132H], Uniprot O75874
DOI: 10.7270/q2r214m7
title: BindingDB Entry 50006325: Computer-Aided Selective Optimization of Side Activities of Talinolol.

description: Small molecule binding data for protein Beta-1 adrenergic receptor, Beta-2 adrenergic receptor, and Bifunctional epoxide hydrolase 2, Uniprot P07550, P08588, and P34913
DOI: 10.7270/q2r214np
title: BindingDB Entry 50006997: Inhibiting Hedgehog: An Update on Pharmacological Compounds and Targeting Strategies.

description: Small molecule binding data for protein Protein-cysteine N-palmitoyltransferase HHAT, Sonic hedgehog protein, Zinc finger protein GLI1/GLI2, and Zinc finger protein GLI2, Uniprot P47806, Q0VGT2, Q15465, Q5VTY9, and Q62226
DOI: 10.7270/q2r214p4
title: BindingDB Entry 50007266: Rational design of 5-((1H-imidazol-1-yl)methyl)quinolin-8-ol derivatives as novel bromodomain-containing protein 4 inhibitors.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2 and Bromodomain-containing protein 4, Uniprot O60885 and P40989
DOI: 10.7270/q2r214qk
title: BindingDB Entry 50007610: How To Design Selective Ligands for Highly Conserved Binding Sites: A Case Study Using

description: Small molecule binding data for protein Glycylpeptide N-tetradecanoyltransferase and Glycylpeptide N-tetradecanoyltransferase 1, Uniprot P30419 and Q4Q5S8
DOI: 10.7270/q2r214r1
title: BindingDB Entry 50008215: Structure-activity relationships of thiazole and benzothiazole derivatives as selective cannabinoid CB2 agonists with in vivo anti-inflammatory properties.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q2r214sg
title: BindingDB Entry 50008862: Identification of potent, selective and orally bioavailable phenyl ((R)-3-phenylpyrrolidin-3-yl)sulfone analogues as RORγt inverse agonists.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Nuclear receptor ROR-alpha, Nuclear receptor ROR-beta, Nuclear receptor ROR-gamma, Nuclear receptor subfamily 1 group I member 2, Oxysterols receptor LXR-alpha, and Oxysterols receptor LXR-beta, Uniprot O75469, P05177, P08684, P10632, P10635, P11712, P20813, P33261, P35398, P51449, P55055, Q13133, and Q92753
DOI: 10.7270/q2r214tx
title: BindingDB Entry 50009479: The identification and pharmacological evaluation of potent, selective and orally available ACC1 inhibitor.

description: Small molecule binding data for protein Acetyl-CoA carboxylase 1 and Acetyl-CoA carboxylase 2, Uniprot E9Q4Z2, O00763, Q13085, and Q5SWU9
DOI: 10.7270/q2r214vc
title: BindingDB Entry 50010092: Indole-based allosteric inhibitors of HIV-1 integrase.

description: Small molecule binding data for protein Integrase, Uniprot Q76353