cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q29g5pcb
title: BindingDB Entry 50044514: Dithiaarsanes induce oxidative stress-mediated apoptosis in HL-60 cells by selectively targeting thioredoxin reductase.

description: Small molecule binding data for protein Glutathione reductase, Uniprot P70619
DOI: 10.7270/q29p3388
title: BindingDB Entry 50045048: Fragment-based discovery of type I inhibitors of maternal embryonic leucine zipper kinase.

description: Small molecule binding data for protein CaM kinase II, MAP kinase signal-integrating kinase 2, Maternal embryonic leucine zipper kinase (MELK), SM myosin light chain kinase (smMLCK), and Tyrosine-protein kinase receptor FLT3, Uniprot A0A024RDK3, P36888, Q13555, Q13557, Q14680, Q15746, and Q9HBH9
DOI: 10.7270/q2b859j8
title: BindingDB Entry 50043372: Quinazolin-4-one derivatives as selective histone deacetylase-6 inhibitors for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, and Cytochrome P450 2D6 (2D6), Uniprot P05177, P10635, P11712, and P33261
DOI: 10.7270/q2dn46s6
title: BindingDB Entry 50046009: Discovery of potent indenoisoquinoline topoisomerase I poisons lacking the 3-nitro toxicophore.

description: Small molecule binding data for protein Tyrosyl-DNA phosphodiesterase 1 (TDP1) and tyrosyl-DNA phosphodiesterase 2, Uniprot O95551 and Q9NUW8
DOI: 10.7270/q2dv1md5
title: BindingDB Entry 50044007: Novel 5-HT3 antagonists. Indole oxadiazoles.

description: Small molecule binding data for protein Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor, Uniprot P35563 and Q9JJ16
DOI: 10.7270/q2f47qt4
title: BindingDB Entry 50045498: Discovery and evaluation of a novel monocyclic series of CXCR2 antagonists.

description: Small molecule binding data for protein Interleukin-8 receptors, CXCR2, Uniprot P25025
DOI: 10.7270/q2f76f4h
title: BindingDB Entry 50044513: 4-Benzofuranyloxynicotinamide derivatives are novel potent and orally available TGR5 agonists.

description: Small molecule binding data for protein G-protein coupled bile acid receptor 1, Uniprot Q80SS6 and Q8TDU6
DOI: 10.7270/q2ff3tzr
title: BindingDB Entry 50045047: Novel Disubstituted Pyrimidines as Inhibitors of Bruton's Tyrosine Kinase.

description: Small molecule binding data for protein Tyrosine-protein kinase BTK, Uniprot Q06187
DOI: 10.7270/q2g16280
title: BindingDB Entry 50043371: 6-Bromo-8-(4-[(3)H]methoxybenzamido)-4-oxo-4H-chromene-2-carboxylic Acid: a powerful tool for studying orphan G protein-coupled receptor GPR35.

description: Small molecule binding data for protein G-protein coupled receptor 35, Uniprot Q9HC97
DOI: 10.7270/q2j96842
title: BindingDB Entry 50046008: A Developability-Focused Optimization Approach Allows Identification of in Vivo Fast-Acting Antimalarials: N-[3-[(Benzimidazol-2-yl)amino]propyl]amides.

description: Small molecule binding data for protein Voltage-gated potassium channel, Uniprot Q12809
DOI: 10.7270/q2jw8gjj
title: BindingDB Entry 50045497: Minimization of drug-drug interaction risk and candidate selection in a natural product-based class of gamma-secretase modulators.

description: Small molecule binding data for protein Cytochrome P450 3A, Uniprot P08684
DOI: 10.7270/q2k64kpg
title: BindingDB Entry 50045046: Pyrrolopyridines-quinazolines Inhibitors of PKR-Like ER Kinase.

description: Small molecule binding data for protein Pancreatic endoplasmic reticulum kinase (PERK), Uniprot Q9NZJ5
DOI: 10.7270/q2ks6sz5
title: BindingDB Entry 50043370: Structure-efficiency relationship of [1,2,4]triazol-3-ylamines as novel nicotinamide isosteres that inhibit tankyrases.

description: Small molecule binding data for protein Human diphtheria toxin-like ADP-ribosyltransferase (ARTD2 or PARP2) and poly-ADP-ribose polymerase 1 (PARP1), Uniprot P09874 and Q9UGN5
DOI: 10.7270/q2p270vc
title: BindingDB Entry 50046007: 9-Hydroxycanthin-6-one, aß-Carboline Alkaloid from Eurycoma longifolia, Is the First Wnt Signal Inhibitor through Activation of Glycogen Synthase Kinase 3ß without Depending on Casein Kinase 1a.

description: Small molecule binding data for protein Glycogen synthase kinase-3, Uniprot P49841
DOI: 10.7270/q2pn979q
title: BindingDB Entry 50045496: Isoindoline-1,3-dione derivatives targeting cholinesterases: design, synthesis and biological evaluation of potential anti-Alzheimer's agents.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BuChE), Uniprot O42275, P22303, and P81908
DOI: 10.7270/q2pz5bfb
title: BindingDB Entry 50045045: Novel azaindazole sulfonamides inhibitors of serum and glucocorticoid regulated kinase.

description: Small molecule binding data for protein Serine/threonine-protein kinase Sgk1, Uniprot O00141
DOI: 10.7270/q2s46tgm
title: BindingDB Entry 50044012: A strategy for the incorporation of water molecules present in a ligand binding site into a three-dimensional quantitative structure--activity relationship analysis.

description: Small molecule binding data for protein Muscle glycogen phosphorylase, Uniprot P11217
DOI: 10.7270/q2sj1n66
title: BindingDB Entry 50044518: Design, synthesis, and structure-activity relationship studies of novel thioether pleuromutilin derivatives as potent antibacterial agents.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P05177, P08684, P10635, P11712, and P33261
DOI: 10.7270/q2tq6352
title: BindingDB Entry 50045044: P21-Activated Kinase 4 (PAK4) Inhibitors as Potential Cancer Therapy.

description: Small molecule binding data for protein PAK1 and Serine/threonine-protein kinase PAK 4, Uniprot O96013 and Q13153
DOI: 10.7270/q2ws8vrv
title: BindingDB Entry 50044011: Hydroxamic acid-based bisubstrate analog inhibitors of Ras farnesyl protein transferase.

description: Small molecule binding data for protein Protein Farnesyltransferase (PFT), Uniprot P49354 and P49356
DOI: 10.7270/q2x63ph6
title: BindingDB Entry 50044517: Carbonic anhydrase inhibitors. Synthesis of a novel series of 5-substituted 2,4-dichlorobenzenesulfonamides and their inhibition of human cytosolic isozymes I and II and the transmembrane tumor-associated isozymes IX and XII.

description: Small molecule binding data for protein Carbonic anhydrase, Carbonic anhydrase 12, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, and Q16790
DOI: 10.7270/q20k2b28
title: BindingDB Entry 50044019: N-(2-Benzoylphenyl)-L-tyrosine PPARgamma agonists. 1. Discovery of a novel series of potent antihyperglycemic and antihyperlipidemic agents.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Peroxisome proliferator-activated receptor alpha (PPAR alpha), Peroxisome proliferator-activated receptor delta (PPAR delta), and Peroxisome proliferator-activated receptor gamma, Uniprot P37231, P37238, Q03181, and Q07869
DOI: 10.7270/q24b32sk
title: BindingDB Entry 50044018: Novel antagonists of the 5-HT3 receptor. Synthesis and structure-activity relationships of (2-alkoxybenzoyl)ureas.

description: Small molecule binding data for protein Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor, Uniprot P35563 and Q9JJ16
DOI: 10.7270/q24q7wjp
title: BindingDB Entry 50044523: Structure guided design and kinetic analysis of highly potent benzimidazole inhibitors targeting the PDEd prenyl binding site.

description: Small molecule binding data for protein Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta, Uniprot O43924
DOI: 10.7270/q2542qbg
title: BindingDB Entry 50046011: Discovery of a high affinity and selective pyridine analog as a potential positron emission tomography imaging agent for cannabinoid type 2 receptor.

description: Small molecule binding data for protein Cannabinoid receptor and Cannabinoid receptor 2, Uniprot P34972 and P47936
DOI: 10.7270/q25q4xsd
title: BindingDB Entry 50045500: Structure-activity study for (bis)ureidopropyl- and (bis)thioureidopropyldiamine LSD1 inhibitors with 3-5-3 and 3-6-3 carbon backbone architectures.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A, Amine oxidase [flavin-containing] B, and Lysine-specific histone demethylase 1A, Uniprot O60341, P21397, and P27338
DOI: 10.7270/q26111xq
title: BindingDB Entry 50045049: Structure-Based Design of Type II Inhibitors Applied to Maternal Embryonic Leucine Zipper Kinase.

description: Small molecule binding data for protein Discoidin domain-containing receptor 2, Fibroblast growth factor receptor 1, Focal adhesion kinase 1/vascular endothelial growth factor receptor 3, Kinesin-1 heavy chain/ Tyrosine-protein kinase receptor RET, Macrophage colony stimulating factor receptor, Maternal embryonic leucine zipper kinase (MELK), Neurotrophic tyrosine kinase receptor type 2, Tyrosine-protein kinase Yes, Tyrosine-protein kinase receptor FLT3, and Vascular endothelial growth factor receptor, Uniprot L7RSL3, P07333, P07947, P07949, P11362, P17948, P35916, P36888, Q14680, Q16620, and Q16832
DOI: 10.7270/q27w6dx3
title: BindingDB Entry 50046018: Inhibitors of the PAR-2 Signaling Pathway May Treat Pain and Inflammation.

description: Small molecule binding data for protein Proteinase-activated receptor 2, Uniprot P55085
DOI: 10.7270/q2833thx
title: BindingDB Entry 50044017: Novel 5-HT3 antagonists: indol-3-ylspiro(azabicycloalkane-3,5'(4'H)-oxazoles).

description: Small molecule binding data for protein Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor, Uniprot P35563 and Q9JJ16
DOI: 10.7270/q28g8n8d
title: BindingDB Entry 50044522: Thiosemicarbazide, a fragment with promising indolamine-2,3-dioxygenase (IDO) inhibition properties.

description: Small molecule binding data for protein Indoleamine 2,3-dioxygenase, Uniprot P14902
DOI: 10.7270/q29g5pgp
title: BindingDB Entry 50045499: Design, synthesis and evaluation of novel 5,6,7-trimethoxyflavone-6-chlorotacrine hybrids as potential multifunctional agents for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BuChE), Uniprot O42275, P22303, and P81908
DOI: 10.7270/q2cn75nt
title: BindingDB Entry 50046017: Synthesis and Biological Evaluation of Novel Olean-28,13ß-lactams as Potential Antiprostate Cancer Agents.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P33261, and Q12809
DOI: 10.7270/q2cv4k7b
title: BindingDB Entry 50044016: Mono- and disubstituted-3,8-diazabicyclo[3.2.1]octane derivatives as analgesics structurally related to epibatidine: synthesis, activity, and modeling.

description: Small molecule binding data for protein Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Uniprot P09483 and P12390
DOI: 10.7270/q2d79d04
title: BindingDB Entry 50044521: Novel aza-analogous ergoline derived scaffolds as potent serotonin 5-HT6 and dopamine D2 receptor ligands.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2C (5-HT2C), 5-Hydroxytryptamine receptor 6 (5-HT6), and Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416, P28335, and P50406
DOI: 10.7270/q2hm59zn
title: BindingDB Entry 50044014: 2-, 5-, and 6-Halo-3-(2(S)-azetidinylmethoxy)pyridines: synthesis, affinity for nicotinic acetylcholine receptors, and molecular modeling.

description: Small molecule binding data for protein Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Uniprot P09483 and P12390
DOI: 10.7270/q2j104rf
title: BindingDB Entry 50044520: Multiparameter optimization in CNS drug discovery: design of pyrimido[4,5-d]azepines as potent 5-hydroxytryptamine 2C (5-HT2C) receptor agonists with exquisite functional selectivity over 5-HT2A and 5-HT2B receptors.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), 5-Hydroxytryptamine receptor 6 (5-HT6), 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 1B, 5-hydroxytryptamine receptor 2A, Beta-2 adrenergic receptor and beta-3 adrenergic receptor, and Serotonin receptor (2b and 2c), Uniprot O46635, P07550, P08908, P28222, P28223, P28335, P41595, and P50406
DOI: 10.7270/q2j67jhn
title: BindingDB Entry 50045054: Synthesis and Biological Evaluation of Pyrazolo[1,5-a]pyrimidine Compounds as Potent and Selective Pim-1 Inhibitors.

description: Small molecule binding data for protein Serine/threonine-protein kinase PIM, Tyrosine-protein kinase receptor FLT3, and Voltage-gated potassium channel, Uniprot P11309, P36888, Q12809, and Q9P1W9
DOI: 10.7270/q2n29zp5
title: BindingDB Entry 50046015: Potent and Nontoxic Chemosensitizer of P-Glycoprotein-Mediated Multidrug Resistance in Cancer: Synthesis and Evaluation of Methylated Epigallocatechin, Gallocatechin, and Dihydromyricetin Derivatives.

description: Small molecule binding data for protein ATP-binding cassette sub-family G member 2, Multidrug resistance-associated protein 1, and P-glycoprotein 1, Uniprot P08183, P33527, and Q9UNQ0
DOI: 10.7270/q2nc62qt
title: BindingDB Entry 50044013: Flavonoid derivatives as adenosine receptor antagonists: a comparison of the hypothetical receptor binding site based on a comparative molecular field analysis model.

description: Small molecule binding data for protein Adenosine Receptors A2a (A2a), Adenosine receptor A1, and Adenosine receptor A3, Uniprot P0DMS8, P25099, and P30543
DOI: 10.7270/q2ns0whx
title: BindingDB Entry 50044519: Lead optimization of 1,4-azaindoles as antimycobacterial agents.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P33261, and Q12809
DOI: 10.7270/q2nz8972
title: BindingDB Entry 50045053: Pyrimidine-based tricyclic molecules as potent and orally efficacious inhibitors of wee1 kinase.

description: Small molecule binding data for protein Serine/threonine-protein kinase WEE1, Uniprot P30291
DOI: 10.7270/q2pk0hkh
title: BindingDB Entry 50043377: Synthesis, biological evaluation and molecular docking studies of pyrazole derivatives coupling with a thiourea moiety as novel CDKs inhibitors.

description: Small molecule binding data for protein CDK7/Cyclin H/MNAT1, Cyclin-Dependent Kinase 5 (CDK5), Cyclin-dependent kinase 1, and Cyclin-dependent kinase 6, Uniprot P06493, P50613, Q00534, and Q00535
DOI: 10.7270/q2r49s9s
title: BindingDB Entry 50044021: TBA

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A (5HT1A), Dopamine receptor, and Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416, P35462, and Q64264
DOI: 10.7270/q2rv0qd4
title: BindingDB Entry 50046014: Nodulisporiviridins A-H, Bioactive Viridins from Nodulisporium sp.

description: Small molecule binding data for protein Beta amyloid A4 protein, Uniprot P05067
DOI: 10.7270/q2sq9207
title: BindingDB Entry 50045052: Discovery of a Type III Inhibitor of LIM Kinase 2 That Binds in a DFG-Out Conformation.

description: Small molecule binding data for protein 3-phosphoinositide dependent protein kinase-1, C-RAF, Cyclin-dependent kinase 1, Cyclin-dependent kinase 2, Glycogen synthase kinase-3, Interleukin-1 receptor-associated kinase 4, JAK3/JAK1, LIM domain kinase 1, LIM domain kinase 2, MAP kinase ERK2, Mitogen-activated protein kinase 2, Mitogen-activated protein kinase kinase kinase kinase 4, Mitogen-activated protein kinase kinase kinase kinase 5, Protein kinase C alpha type, Rho-associated protein kinase, SRC, Serine/threonine-protein kinase 4 (STK4), Serine/threonine-protein kinase Chk2, Serine/threonine-protein kinase MST2, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase JAK2, Tyrosine-protein kinase SYK, VEGF-receptor 2 and tyrosine-protein kinase SRC, and Vascular endothelial growth factor receptor, Uniprot L7RSL3, O15530, O60674, O75116, O95819, O96017, P00519, P04049, P06239, P06493, P09769, P12931, P17252, P17948, P24941, P28482, P43405, P49841, P52333, P53667, P53671, Q12851, Q13043, Q13188, and Q9NWZ3
DOI: 10.7270/q2t72jv2
title: BindingDB Entry 50043376: Discovery and biophysical characterization of 2-amino-oxadiazoles as novel antagonists of PqsR, an important regulator of Pseudomonas aeruginosa virulence.

description: Small molecule binding data for protein Transcriptional regulator MvfR
DOI: 10.7270/q2wm1g4v
title: BindingDB Entry 50046013: Synthesis and Biological Evaluation of Cyclopentaquinoline Derivatives as Nonsteroidal Glucocorticoid Receptor Antagonists.

description: Small molecule binding data for protein Androgen Receptor, Estradiol receptor beta (ERβ), Estrogen-related receptor alpha, Glucocorticoid receptor, Mineralocorticoid receptor (MR), and Progesterone receptor, Uniprot P04150, P06401, P08235, P10275, P11474, and Q92731
DOI: 10.7270/q2x63pmj
title: BindingDB Entry 50045502: Iminopyrimidinones: a novel pharmacophore for the development of orally active renin inhibitors.

description: Small molecule binding data for protein Beta-secretase 1, Beta-secretase 2 (BACE2), Cathepsin D, Cathepsin E, Renin, and Voltage-gated potassium channel, Uniprot P00797, P07339, P14091, P56817, Q12809, and Q9Y5Z0
DOI: 10.7270/q2xg9srm
title: BindingDB Entry 50045051: Structure-Based Drug Design of Novel, Potent, and Selective Azabenzimidazoles (ABI) as ATR Inhibitors.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, DNA-dependent protein kinase, PI3-kinase subunit alpha, Serine-protein kinase ATM, Serine/threonine-protein kinase ATR, Serine/threonine-protein kinase Chk1, Serine/threonine-protein kinase mTOR, and Voltage-gated potassium channel, Uniprot O14757, P05177, P08684, P10635, P11712, P42336, P42345, P78527, Q12809, Q13315, and Q13535
DOI: 10.7270/q2z039jb
title: BindingDB Entry 50043375: Inhibitors of switch kinase 'spleen tyrosine kinase' in inflammation and immune-mediated disorders: a review.

description: Small molecule binding data for protein Tyrosine-protein kinase SYK, Uniprot P43405
DOI: 10.7270/q20c4xgc
title: BindingDB Entry 50046020: Antagonism/Agonism modulation to build novel antihypertensives selectively triggering i1-imidazoline receptor activation.

description: Small molecule binding data for protein Nischarin, Uniprot Q4G017
DOI: 10.7270/q20z74vs
title: BindingDB Entry 50044524: Novel pyridyl- or isoquinolinyl-substituted indolines and indoles as potent and selective aldosterone synthase inhibitors.

description: Small molecule binding data for protein Cytochrome P450 11B2, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Steroid 11-beta-Hydroxylase (CYP11B1), Uniprot P05177, P08684, P10635, P11712, P15538, P19099, and P33261
DOI: 10.7270/q218384x
title: BindingDB Entry 50045058: Discovery and Development of LX7101, a Dual LIM-Kinase and ROCK Inhibitor for the Treatment of Glaucoma.

description: Small molecule binding data for protein LIM domain kinase 1, LIM domain kinase 2, and Rho-associated protein kinase, Uniprot O75116, P53667, P53671, and Q13464
DOI: 10.7270/q21r6rx0
title: BindingDB Entry 50043382: Design, synthesis, biological and structural evaluation of functionalized resveratrol analogues as inhibitors of quinone reductase 2.

description: Small molecule binding data for protein Ribosyldihydronicotinamide dehydrogenase [quinone], Uniprot P16083
DOI: 10.7270/q2445p63
title: BindingDB Entry 50046019: Inhibitors of the PD-1/PD-L1 Pathway Can Mobilize the Immune System: An Innovative Potential Therapy for Cancer and Chronic Infections.

description: Small molecule binding data for protein Programmed cell death 1 ligand 1, Uniprot Q9NZQ7
DOI: 10.7270/q24q7wpg
title: BindingDB Entry 50045508: Synthesis and evaluation of tetrahydroindazole derivatives as sigma-2 receptor ligands.

description: Small molecule binding data for protein Sigma-1 receptor, Uniprot Q60492
DOI: 10.7270/q25140v7
title: BindingDB Entry 50045057: Structural Analysis of the Binding of Type I, I1/2, and II Inhibitors to Eph Tyrosine Kinases.

description: Small molecule binding data for protein Ephrin type-B receptor 4 (EphB4), Uniprot P54760 and Q541P7
DOI: 10.7270/q25h7hp5
title: BindingDB Entry 50043381: Identification of potent, selective, CNS-targeted inverse agonists of the ghrelin receptor.

description: Small molecule binding data for protein Ghrelin receptor and Muscarinic acetylcholine receptor M2, Uniprot P08172 and Q92847
DOI: 10.7270/q28g8nd6
title: BindingDB Entry 50045507: Synthesis of 3-azabicyclo[3.2.2]nonanes and their antiprotozoal activities.

description: Small molecule binding data for protein Voltage-gated potassium channel, Uniprot Q12809
DOI: 10.7270/q28s4rjt
title: BindingDB Entry 50045056: Discovery of N-[4-(1H-Pyrazolo[3,4-b]pyrazin-6-yl)-phenyl]-sulfonamides as Highly Active and Selective SGK1 Inhibitors.

description: Small molecule binding data for protein Cytochrome P450 3A, Serine/threonine-protein kinase Sgk1, Serine/threonine-protein kinase Sgk2, and Serine/threonine-protein kinase Sgk3, Uniprot O00141, P08684, Q96BR1, and Q9HBY8
DOI: 10.7270/q29888fb
title: BindingDB Entry 50043380: Discovery of potent and selective nonsteroidal indazolyl amide glucocorticoid receptor agonists.

description: Small molecule binding data for protein Androgen Receptor, Glucocorticoid receptor, Mineralocorticoid receptor (MR), and Progesterone receptor, Uniprot P04150, P06401, P08235, and P10275
DOI: 10.7270/q2bv7j4d
title: BindingDB Entry 50044024: Three-dimensional pharmacophores from binding data.

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q2c82bvw
title: BindingDB Entry 50044529: Biarylmethoxy Nicotinamides As Novel and Specific Inhibitors of Mycobacterium tuberculosis.

description: Small molecule binding data for protein Cytochrome P450 2C19 and Cytochrome P450 2C9, Uniprot P11712 and P33261
DOI: 10.7270/q2d79d3g
title: BindingDB Entry 50045506: Discovery of novel S1P2 antagonists. Part 1: discovery of 1,3-bis(aryloxy)benzene derivatives.

description: Small molecule binding data for protein Lysophosphatidic acid receptor 1 (LPAR1), Lysophosphatidic acid receptor Edg-4, Sphingosine 1-Phosphate Receptor 2, Sphingosine 1-Phosphate Receptor 4, Sphingosine 1-Phosphate Receptor 5, Sphingosine 1-phosphate receptor, and Sphingosine 1-phosphate receptor 3, Uniprot O95136, O95977, P21453, Q92633, Q99500, Q9H228, and Q9HBW0
DOI: 10.7270/q2df6stc
title: BindingDB Entry 50045055: Unfolded Protein Response in Cancer: IRE1a Inhibition by Selective Kinase Ligands Does Not Impair Tumor Cell Viability.

description: Small molecule binding data for protein Mitogen-activated protein kinase 10 and Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha, Uniprot O75460 and P53779
DOI: 10.7270/q2f19152
title: BindingDB Entry 50043379: Dihydrothiazolopyridone derivatives as a novel family of positive allosteric modulators of the metabotropic glutamate 5 (mGlu5) receptor.

description: Small molecule binding data for protein GRM7, GRM8, Metabotropic glutamate receptor 1, Metabotropic glutamate receptor 2 (mGluR2), Metabotropic glutamate receptor 4 (mGluR4), Metabotropic glutamate receptor 5, and metabotropic glutamate 1c, Uniprot O00222, P41594, Q13255, Q14416, Q14831, Q14832, and Q14833
DOI: 10.7270/q2gf0w8s
title: BindingDB Entry 50046024: Design and Validation of FRESH, a Drug Discovery Paradigm Resting on Robust Chemical Synthesis.

description: Small molecule binding data for protein Carbonic anhydrase 2, Uniprot P00918
DOI: 10.7270/q2gm88t8
title: BindingDB Entry 50044023: 2-(Quinuclidin-3-yl)pyrido[4,3-b]indol-1-ones and isoquinolin-1-ones. Potent conformationally restricted 5-HT3 receptor antagonists.

description: Small molecule binding data for protein Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor, Uniprot P35563 and Q9JJ16