cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2cn77r0
title: BindingDB Entry 50014578: Optimization of TopoIV Potency, ADMET Properties, and hERG Inhibition of 5-Amino-1,3-dioxane-Linked Novel Bacterial Topoisomerase Inhibitors: Identification of a Lead with

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Cytochrome P450 1A2, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, DNA gyrase subunit A/B, and DNA topoisomerase 4 subunit A/B, Uniprot P05177, P0A0K8, P0C1U9, P10632, P10635, P11712, P20813, P20831, P33261, P40989, and Q2FYS5
DOI: 10.7270/q2cr5xd2
title: BindingDB Entry 9399: Thiazolidinedione derivative and use thereof

description: Small molecule binding data for protein 15-hydroxyprostaglandin dehydrogenase [NAD(+)], Uniprot P15428
DOI: 10.7270/q2cr5xfh
title: BindingDB Entry 9786: Treatment of relapsed and/or refractory solid tumors and non-hodgkin's lymphomas

description: Small molecule binding data for protein Lysine-specific histone demethylase 1A, Uniprot O60341
DOI: 10.7270/q2cr5xgz
title: BindingDB Entry 10173: Disubstituted pyrazole compounds

description: Small molecule binding data for protein Isoform A of Ketohexokinase (Peripheral) and Ketohexokinase, Uniprot P50053
DOI: 10.7270/q2cr5xhd
title: BindingDB Entry 10382: Substituted bridged diazepane derivatives and use thereof as TASK-1 and TASK-3 inhibitors

description: Small molecule binding data for protein Potassium channel subfamily K member 3 and Potassium channel subfamily K member 9, Uniprot O14649 and Q9NPC2
DOI: 10.7270/q2cr5xjv
title: BindingDB Entry 10560: Inhibitors of KRAS G12C and methods of using the same

description: Small molecule binding data for protein GTPase KRas [1-169,G12D], Uniprot P01116
DOI: 10.7270/q2cr5xk9
title: BindingDB Entry 10769: Treatment of tachycardia

description: Small molecule binding data for protein cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A and cGMP-dependent 3',5'-cyclic phosphodiesterase, Uniprot O00408, Q9QYJ6, and Q9Y233
DOI: 10.7270/q2cr5xmr
title: BindingDB Entry 50004566: Synthesis and Structure-Activity Relationships of 3,5-Disubstituted-pyrrolo[2,3- b]pyridines as Inhibitors of Adaptor-Associated Kinase 1 with Antiviral Activity.

description: Small molecule binding data for protein AP2-associated protein kinase 1, BMP-2-inducible protein kinase, Cyclin-G-associated kinase, and Serine/threonine-protein kinase 16, Uniprot O14976, O75716, Q2M2I8, and Q9NSY1
DOI: 10.7270/q2cr5xn6
title: BindingDB Entry 50006987: Discovery of 1,3-diphenyl-1H-pyrazole derivatives containing rhodanine-3-alkanoic acid groups as potential PTP1B inhibitors.

description: Small molecule binding data for protein M-phase inducer phosphatase 2, Receptor-type tyrosine-protein phosphatase F, Tyrosine-protein phosphatase non-receptor type 1, Tyrosine-protein phosphatase non-receptor type 11, Tyrosine-protein phosphatase non-receptor type 2, and Tyrosine-protein phosphatase non-receptor type 6, Uniprot P10586, P17706, P18031, P29350, P30305, and Q06124
DOI: 10.7270/q2cr5xpn
title: BindingDB Entry 50007603: Revealing quinquennial anticancer journey of morpholine: A SAR based review.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q2cr5xq3
title: BindingDB Entry 50008207: Discovery of a Potent Kelch-Like ECH-Associated Protein 1-Nuclear Factor Erythroid 2-Related Factor 2 (Keap1-Nrf2) Protein-Protein Interaction Inhibitor with Natural Proline Structure as a Cytoprotective Agent against Acetaminophen-Induced Hepatotoxicity.

description: Small molecule binding data for protein Kelch-like ECH-associated protein 1, Uniprot Q14145
DOI: 10.7270/q2cr5xrj
title: BindingDB Entry 50008856: Structure-activity relationship study of thiazolyl-hydroxamate derivatives as selective histone deacetylase 6 inhibitors.

description: Small molecule binding data for protein Histone deacetylase 1 and Histone deacetylase 6, Uniprot Q13547 and Q9UBN7
DOI: 10.7270/q2cr5xs0
title: BindingDB Entry 50009182: Targeted Endocrine Therapy: Design, Synthesis, and Proof-of-Principle of 17β-Hydroxysteroid Dehydrogenase Type 2 Inhibitors in Bone Fracture Healing.

description: Small molecule binding data for protein 17-beta-hydroxysteroid dehydrogenase type 1, 17-beta-hydroxysteroid dehydrogenase type 2, and Estradiol 17-beta-dehydrogenase 2, Uniprot P14061, P37059, P51656, and P51658
DOI: 10.7270/q2cr5xtf
title: BindingDB Entry 50009470: Synthesis of 2-arylhydrazinylidene-3-oxo-4,4,4-trifluorobutanoic acids as new selective carboxylesterase inhibitors and radical scavengers.

description: Small molecule binding data for protein Liver carboxylesterase, Uniprot Q29550
DOI: 10.7270/q2cr5xvw
title: BindingDB Entry 50009807: Thiolactomycin-Based Inhibitors of Bacterial β-Ketoacyl-ACP Synthases with in Vivo Activity.

description: Small molecule binding data for protein 3-oxoacyl-[acyl-carrier-protein] synthase 2, Uniprot Q5TKS0
DOI: 10.7270/q2cr5xwb
title: BindingDB Entry 50010379: Regiospecific Introduction of Halogens on the 2-Aminobiphenyl Subunit Leading to Highly Potent and Selective M3 Muscarinic Acetylcholine Receptor Antagonists and Weak Inverse Agonists.

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M2, and Muscarinic acetylcholine receptor M3, Uniprot P08172, P08482, P08483, P10980, P11229, and P20309
DOI: 10.7270/q2cr5xxs
title: BindingDB Entry 50010995: Discovery of novel potent GPR40 agonists containing imidazo[1,2-a]pyridine core as antidiabetic agents.

description: Small molecule binding data for protein Free fatty acid receptor 1, Uniprot O14842
DOI: 10.7270/q2cr5xz7
title: BindingDB Entry 50011618: Design, synthesis and stepwise optimization of nitrile-based inhibitors of cathepsins B and L.

description: Small molecule binding data for protein Cathepsin B, Cathepsin K, Cathepsin S, and Procathepsin L, Uniprot P07711, P07858, P25774, and P43235
DOI: 10.7270/q2cr5z03
title: BindingDB Entry 50012242: Discovery of MGS0274, an ester prodrug of a metabotropic glutamate receptor 2/3 agonist with improved oral bioavailability.

description: Small molecule binding data for protein Metabotropic glutamate receptor 1, Metabotropic glutamate receptor 2, Metabotropic glutamate receptor 3, Metabotropic glutamate receptor 4, Metabotropic glutamate receptor 6, and Metabotropic glutamate receptor 8, Uniprot O00222, O15303, P31421, P31422, Q13255, Q14416, Q14832, and Q14833
DOI: 10.7270/q2cr5z1j
title: BindingDB Entry 50012587: Multitarget-directed oxoisoaporphine derivatives: Anti-acetylcholinesterase, anti-β-amyloid aggregation and enhanced autophagy activity against Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275
DOI: 10.7270/q2cr5z20
title: BindingDB Entry 50012866: Synthesis and pharmacological evaluation of piperidine (piperazine)-amide substituted derivatives as multi-target antipsychotics.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 2A, 5-hydroxytryptamine receptor 2C, 5-hydroxytryptamine receptor 6, Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor, Alpha-2A adrenergic receptor, D(2) dopamine receptor, and Histamine H1 receptor, Uniprot P08908, P08913, P14416, P25100, P28223, P28335, P35348, P35367, P35368, P40989, and P50406
DOI: 10.7270/q2cr5z3f
title: BindingDB Entry 50013218: Identification of a Human Toll-Like Receptor (TLR) 8-Specific Agonist and a Functional Pan-TLR Inhibitor in 2-Aminoimidazoles.

description: Small molecule binding data for protein Calcium/calmodulin-dependent protein kinase type 1, Calcium/calmodulin-dependent protein kinase type 1B, Calcium/calmodulin-dependent protein kinase type 1D, Calcium/calmodulin-dependent protein kinase type 1G, Calcium/calmodulin-dependent protein kinase type II subunit alpha, Calcium/calmodulin-dependent protein kinase type II subunit beta, Calcium/calmodulin-dependent protein kinase type II subunit delta, Calcium/calmodulin-dependent protein kinase type II subunit gamma, Calcium/calmodulin-dependent protein kinase type IV, Toll-like receptor 2, Toll-like receptor 3, Toll-like receptor 4, Toll-like receptor 5, Toll-like receptor 7, Toll-like receptor 8, and Toll-like receptor 9, Uniprot O00206, O15455, O60602, O60603, Q13554, Q13555, Q13557, Q14012, Q16566, Q6P2M8, Q8IU85, Q96NX5, Q9NR96, Q9NR97, Q9NYK1, and Q9UQM7
DOI: 10.7270/q2cr5z4w
title: BindingDB Entry 50013860: Structure based design and synthesis of novel Toll-like Receptor 2 (TLR 2) lipid antagonists.

description: Small molecule binding data for protein Toll-like receptor 2 and Tumor necrosis factor, Uniprot O60603 and P01375
DOI: 10.7270/q2cr5z5b
title: BindingDB Entry 50014516: Discovery of pyrrolo[2,3-d]pyrimidine derivatives as potent Axl inhibitors: Design, synthesis and biological evaluation.

description: Small molecule binding data for protein Ephrin type-A receptor 2, Epidermal growth factor receptor, Hepatocyte growth factor receptor, Insulin-like growth factor 1 receptor, Mast/stem cell growth factor receptor Kit, Platelet-derived growth factor receptor alpha, Platelet-derived growth factor receptor beta, Proto-oncogene tyrosine-protein kinase Src, Receptor tyrosine-protein kinase erbB-2, Receptor tyrosine-protein kinase erbB-4, Receptor-type tyrosine-protein kinase FLT3, Tyrosine-protein kinase receptor UFO, Vascular endothelial growth factor receptor 1, and Vascular endothelial growth factor receptor 2, Uniprot P00533, P04626, P08069, P08581, P09619, P10721, P12931, P16234, P17948, P29317, P30530, P35968, P36888, and Q15303
DOI: 10.7270/q2cv4msx
title: BindingDB Entry 9190: FGFR3 fusion gene and pharmaceutical drug targeting same

description: Small molecule binding data for protein Fibroblast growth factor receptor 1, Fibroblast growth factor receptor 2, and Fibroblast growth factor receptor 3, Uniprot P11362, P21802, and P22607
DOI: 10.7270/q2cv4mtc
title: BindingDB Entry 9368: PD-1/PD-L1 inhibitors

description: Small molecule binding data for protein Programmed cell death 1 ligand 1 [19-238]/protein 1 [25-167], Uniprot Q15116 and Q9NZQ7
DOI: 10.7270/q2cv4mvt
title: BindingDB Entry 9577: Substituted bicyclic heterocyclic compounds

description: Small molecule binding data for protein ATP-sensitive inward rectifier potassium channel 1, Uniprot P48048
DOI: 10.7270/q2cv4mw8
title: BindingDB Entry 9964: Naphthyridines as inhibitors of HPK1

description: Small molecule binding data for protein Mitogen-activated protein kinase kinase kinase kinase 1, Uniprot Q92918
DOI: 10.7270/q2cv4mxq
title: BindingDB Entry 10351: Iridinesulfonamide compound and use method thereof

description: Small molecule binding data for protein Isocitrate dehydrogenase [NADP] cytoplasmic [R132C] and Isocitrate dehydrogenase [NADP] cytoplasmic [R132H], Uniprot O75874
DOI: 10.7270/q2cv4mz5
title: BindingDB Entry 10738: Tropomyosin-related kinase (TRK) inhibitors

description: Small molecule binding data for protein BDNF/NT-3 growth factors receptor, High affinity nerve growth factor receptor, Macrophage colony-stimulating factor 1 receptor, and NT-3 growth factor receptor, Uniprot P04629, P07333, Q16288, and Q16620
DOI: 10.7270/q2cv4n01
title: BindingDB Entry 50006940: Discovery of covalent prolyl oligopeptidase boronic ester inhibitors.

description: Small molecule binding data for protein Prolyl endopeptidase, Uniprot P48147
DOI: 10.7270/q2cv4n1g
title: BindingDB Entry 50007254: Discovery of Novel Quinoline-Chalcone Derivatives as Potent Antitumor Agents with Microtubule Polymerization Inhibitory Activity.

description: Small molecule binding data for protein Tubulin beta chain, Uniprot P02554
DOI: 10.7270/q2cv4n2x
title: BindingDB Entry 50007548: Identification and SAR exploration of a novel series of Legumain inhibitors.

description: Small molecule binding data for protein Legumain, Uniprot Q99538
DOI: 10.7270/q2cv4n3c
title: BindingDB Entry 50007865: Human constitutive androstane receptor agonist DL5016: A novel sensitizer for cyclophosphamide-based chemotherapies.

description: Small molecule binding data for protein Nuclear receptor subfamily 1 group I member 3, Uniprot Q14994
DOI: 10.7270/q2cv4n4t
title: BindingDB Entry 50008474: Hot-Spots of Mcl-1 Protein.

description: Small molecule binding data for protein Apoptosis regulator Bcl-2, Bcl-2-like protein 1, and Induced myeloid leukemia cell differentiation protein Mcl-1, Uniprot P10415, Q07817, and Q07820
DOI: 10.7270/q2cv4n58
title: BindingDB Entry 50009122: Identification of new dual FABP4/5 inhibitors based on a naphthalene-1-sulfonamide FABP4 inhibitor.

description: Small molecule binding data for protein Fatty acid-binding protein 5, Fatty acid-binding protein, adipocyte, and Fatty acid-binding protein, heart, Uniprot P05413, P15090, and Q01469
DOI: 10.7270/q2cv4n6q
title: BindingDB Entry 50009759: Design and Synthesis of a Novel and Selective Kappa Opioid Receptor (KOR) Antagonist (BTRX-335140).

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Cytochrome P450 1A2, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Delta-type opioid receptor, Kappa-type opioid receptor, and Mu-type opioid receptor, Uniprot P05177, P08684, P10632, P10635, P11712, P20813, P33261, P35372, P40989, P41143, and P41145
DOI: 10.7270/q2cv4n75
title: BindingDB Entry 50010087: Design, Synthesis, and Characterization of Sulfamide and Sulfamate Nucleotidomimetic Inhibitors of hHint1.

description: Small molecule binding data for protein Adenosine 5'-monophosphoramidase HINT1, Uniprot P49773
DOI: 10.7270/q2cv4n8m
title: BindingDB Entry 50010337: Discovery of novel pyrrolo[2,3-b]pyridine derivatives bearing 4-oxoquinoline moiety as potential antitumor inhibitor.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, Hepatocyte growth factor receptor, Macrophage-stimulating protein receptor, Mast/stem cell growth factor receptor Kit, Platelet-derived growth factor receptor beta, Receptor-type tyrosine-protein kinase FLT3, and Vascular endothelial growth factor receptor 2, Uniprot P08581, P09619, P10721, P35968, P36888, Q04912, and Q9UM73
DOI: 10.7270/q2cv4n92
title: BindingDB Entry 50010639: Benzofuran-Based Carboxylic Acids as Carbonic Anhydrase Inhibitors and Antiproliferative Agents against Breast Cancer.

description: Small molecule binding data for protein Carbonic anhydrase 1, Carbonic anhydrase 12, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, and Q16790
DOI: 10.7270/q2cv4nbh
title: BindingDB Entry 50011282: Lowering Lipophilicity by Adding Carbon: AzaSpiroHeptanes, a log

description: Small molecule binding data for protein Glucose-dependent insulinotropic receptor, Uniprot Q8TDV5
DOI: 10.7270/q2cv4ncz
title: BindingDB Entry 50011913: Identification of N-acyl-N-indanyl-α-phenylglycinamides as selective TRPM8 antagonists designed to mitigate the risk of adverse effects.

description: Small molecule binding data for protein Nuclear receptor subfamily 1 group I member 2, Transient receptor potential cation channel subfamily A member 1, Transient receptor potential cation channel subfamily M member 8, Transient receptor potential cation channel subfamily V member 1, and Transient receptor potential cation channel subfamily V member 4, Uniprot O75469, O75762, Q7Z2W7, Q8NER1, Q8R455, and Q9HBA0
DOI: 10.7270/q2cv4ndd
title: BindingDB Entry 50012542: Novel 5-substituted-2-anilinoquinolines with 3-(morpholino or 4-methylpiperazin-1-yl)propoxy moiety as broad spectrum antiproliferative agents: Synthesis, cell based assays and kinase screening.

description: Small molecule binding data for protein High affinity nerve growth factor receptor, Uniprot P04629
DOI: 10.7270/q2cv4nfv
title: BindingDB Entry 50013174: Multifunctional agents based on benzoxazolone as promising therapeutic drugs for diabetic nephropathy.

description: Small molecule binding data for protein Aldo-keto reductase family 1 member B1, Uniprot P07943
DOI: 10.7270/q2cv4ng9
title: BindingDB Entry 50013512: 2-(Halogenated Phenyl) acetamides and propanamides as potent TRPV1 antagonists.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily V member 1, Uniprot Q8NER1
DOI: 10.7270/q2cv4nhr
title: BindingDB Entry 50013809: Structure-Activity Relationships for the Marine Natural Product Sintokamides: Androgen Receptor N-Terminus Antagonists of Interest for Treatment of Metastatic Castration-Resistant Prostate Cancer.

description: Small molecule binding data for protein Androgen receptor, Uniprot P10275
DOI: 10.7270/q2cv4nj6
title: BindingDB Entry 50014167: Optimization of 4,6-Disubstituted Pyrido[3,2-

description: Small molecule binding data for protein Epidermal growth factor receptor, MAP kinase-interacting serine/threonine-protein kinase 1, MAP kinase-interacting serine/threonine-protein kinase 2, Receptor tyrosine-protein kinase erbB-2, Serine/threonine-protein kinase B-raf, Serine/threonine-protein kinase pim-1, Serine/threonine-protein kinase pim-2, and Serine/threonine-protein kinase pim-3, Uniprot P00533, P04626, P11309, P15056, Q86V86, Q9BUB5, Q9HBH9, and Q9P1W9
DOI: 10.7270/q2cz3b6n
title: BindingDB Entry 9159: Isoxazole carboxamides as irreversible SMYD inhibitors

description: Small molecule binding data for protein Histone-lysine N-methyltransferase SMYD3, Uniprot Q9H7B4
DOI: 10.7270/q2cz3b73
title: BindingDB Entry 9546: Pyrrolotriazine compounds as TAM inhibitors

description: Small molecule binding data for protein Tyrosine-protein kinase Mer, Tyrosine-protein kinase receptor TYRO3, and Tyrosine-protein kinase receptor UFO, Uniprot P30530, Q06418, and Q12866
DOI: 10.7270/q2cz3b8j
title: BindingDB Entry 9755: Inhibitors of Hepatitis C virus polymerase

description: Small molecule binding data for protein Genome polyprotein, Uniprot Q81495
DOI: 10.7270/q2cz3b90
title: BindingDB Entry 9933: 1,4-thiazine dioxide and 1,2,4-thiadiazine dioxide derivatives as beta-secretase inhibitors and methods of use

description: Small molecule binding data for protein Beta-secretase 1, Beta-secretase 2, and Cathepsin D, Uniprot P07339, P56817, and Q9Y5Z0
DOI: 10.7270/q2cz3bbf
title: BindingDB Entry 10142: Pyrrolo[1,2-b]pyridazine derivatives

description: Small molecule binding data for protein Interleukin-1 receptor-associated kinase 4, Uniprot Q9NWZ3
DOI: 10.7270/q2cz3bcw
title: BindingDB Entry 10529: Substituted piperidine compound and use thereof

description: Small molecule binding data for protein Orexin receptor type 2, Uniprot O43614
DOI: 10.7270/q2cz3bdb
title: BindingDB Entry 10916: Method for treating inflammation

description: Small molecule binding data for protein Prostaglandin G/H synthase 1 and Prostaglandin G/H synthase 2, Uniprot P23219 and P35354
DOI: 10.7270/q2cz3bfs
title: BindingDB Entry 50007204: Heterocyclic Amides as Kinase Inhibitors.

description: Small molecule binding data for protein Receptor-interacting serine/threonine-protein kinase 1, Uniprot Q13546
DOI: 10.7270/q2cz3bg7
title: BindingDB Entry 50007821: Structural Basis for E. coli Penicillin Binding Protein (PBP) 2 Inhibition, a Platform for Drug Design.

description: Small molecule binding data for protein Peptidoglycan D,D-transpeptidase MrdA, Uniprot Q2TL65
DOI: 10.7270/q2cz3bhp
title: BindingDB Entry 50008155: Synthesis and anti-tumor efficacy of novel 2, 4-diarylaminopyrimidine derivatives bearing N-(3-pyridinylmethyl) urea moiety as anaplastic lymphoma kinase inhibitors.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, Uniprot Q9UM73
DOI: 10.7270/q2cz3bj4
title: BindingDB Entry 50008422: Bioactivatable Pseudotripeptidization of Cyclic Dipeptides To Increase the Affinity toward Oligopeptide Transporter 1 for Enhanced Oral Absorption: An Application to Cyclo(l-Hyp-l-Ser) (JBP485).

description: Small molecule binding data for protein Solute carrier family 15 member 1, Uniprot P46059
DOI: 10.7270/q2cz3bkk
title: BindingDB Entry 50008798: Galloyl Carbohydrates with Antiangiogenic Activity Mediated by Capillary Morphogenesis Gene 2 (CMG2) Protein Binding.

description: Small molecule binding data for protein Anthrax toxin receptor 2, Uniprot P58335
DOI: 10.7270/q2cz3bm1
title: BindingDB Entry 50009415: Phenolic N-monosubstituted carbamates: Antitubercular and toxicity evaluation of multi-targeting compounds.

description: Small molecule binding data for protein Isocitrate lyase, Uniprot P9WKK7
DOI: 10.7270/q2cz3bng
title: BindingDB Entry 50010032: Development of a Single-Chain Peptide Agonist of the Relaxin-3 Receptor Using Hydrocarbon Stapling.

description: Small molecule binding data for protein Relaxin receptor 1, Relaxin-3 receptor 1, and Relaxin-3 receptor 2, Uniprot Q8TDU9, Q9HBX9, and Q9NSD7
DOI: 10.7270/q2cz3bpx
title: BindingDB Entry 50010584: Design, Synthesis, and Biological Evaluation of New Peripheral 5HT

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 2A, Uniprot P28223
DOI: 10.7270/q2cz3bqc
title: BindingDB Entry 50010948: Discovery of ethyl ketone-based 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/q2cz3brt
title: BindingDB Entry 50011228: Chemical probes and inhibitors of bromodomains outside the BET family.

description: Small molecule binding data for protein Chromatin remodeling regulator CECR2, Nucleosome-remodeling factor subunit BPTF, and Peregrin, Uniprot P55201, Q12830, and Q9BXF3
DOI: 10.7270/q2cz3bs8
title: BindingDB Entry 50011574: Pyrrolinone derivatives as a new class of P2X3 receptor antagonists. Part 3: Structure-activity relationships of pyrropyrazolone derivatives.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C9, Cytochrome P450 3A4, and P2X purinoceptor 3, Uniprot P05177, P08684, P11712, and P56373
DOI: 10.7270/q2cz3btq
title: BindingDB Entry 50011855: Study on chemical modification and analgesic activity of N-(4-tert-butylphenyl)-4-(3-chloropyridin-2-yl) piperazine-1-carboxamide.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily V member 1, Uniprot Q8NER1
DOI: 10.7270/q2cz3bv5
title: BindingDB Entry 50012187: Rational Design of 2-Chloroadenine Derivatives as Highly Selective Phosphodiesterase 8A Inhibitors.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11A, Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B, High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A, High affinity cAMP-specific and IBMX-insensitive 3',5'-cyclic phosphodiesterase 8A, High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4D, cGMP-dependent 3',5'-cyclic phosphodiesterase, and cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A, Uniprot O00408, O60658, O76083, P05177, P08684, P10635, P11712, P33261, P40989, Q01064, Q08499, Q13946, Q14432, Q9HCR9, and Q9Y233
DOI: 10.7270/q2cz3bwm
title: BindingDB Entry 50012813: The design of a novel near-infrared fluorescent HDAC inhibitor and image of tumor cells.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 3, and Histone deacetylase 6, Uniprot O15379, Q13547, and Q9UBN7
DOI: 10.7270/q2cz3bx2
title: BindingDB Entry 50013464: Berberine Directly Targets the NEK7 Protein to Block the NEK7-NLRP3 Interaction and Exert Anti-inflammatory Activity.

description: Small molecule binding data for protein Serine/threonine-protein kinase Nek7, Uniprot Q8TDX7