cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2tx3jhv
title: BindingDB Entry 10154: Apoptosis signal-regulating kinase inhibitors

description: Small molecule binding data for protein Mitogen-activated protein kinase kinase kinase 5, Uniprot Q99683
DOI: 10.7270/q2tx3jj9
title: BindingDB Entry 10363: PREPARATION OF OXINDOLE DERIVATIVES AS NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS

description: Small molecule binding data for protein Diacylglycerol O-acyltransferase 2, Uniprot Q96PD7
DOI: 10.7270/q2tx3jkr
title: BindingDB Entry 10750: Dioxinoquinoline compounds, preparation method and uses thereof

description: Small molecule binding data for protein Hepatocyte growth factor receptor and Vascular endothelial growth factor receptor 2, Uniprot P08581 and P35968
DOI: 10.7270/q2tx3jm6
title: BindingDB Entry 50006957: Design, Synthesis, and Biological Evaluation of Novel DNA Gyrase-Inhibiting Spiropyrimidinetriones as Potent Antibiotics for Treatment of Infections Caused by Multidrug-Resistant Gram-Positive Bacteria.

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, DNA gyrase subunit A/B, and DNA topoisomerase 2-alpha, Uniprot P05177, P08684, P0A0K8, P10635, P11388, P11712, P20831, P33261, and P40989
DOI: 10.7270/q2tx3jnn
title: BindingDB Entry 50007568: Fasudil dichloroacetate (FDCA), an orally available agent with potent therapeutic efficiency on monocrotaline-induced pulmonary arterial hypertension rats.

description: Small molecule binding data for protein Rho-associated protein kinase 2, Uniprot O75116
DOI: 10.7270/q2tx3jp3
title: BindingDB Entry 50007885: Antifungal activity, mode of action variability, and subcellular distribution of coumarin-based antifungal azoles.

description: Small molecule binding data for protein Cytochrome P450 3A4, Uniprot P08684
DOI: 10.7270/q2tx3jqj
title: BindingDB Entry 50008168: Discovery of a Lead Triphenylethanamine Cholesterol Ester Transfer Protein (CETP) Inhibitor.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2 and Cholesteryl ester transfer protein, Uniprot P11597 and P40989
DOI: 10.7270/q2tx3jr0
title: BindingDB Entry 50008489: "A Sweet Combination": Developing Saccharin and Acesulfame K Structures for Selectively Targeting the Tumor-Associated Carbonic Anhydrases IX and XII.

description: Small molecule binding data for protein Carbonic anhydrase 1, Carbonic anhydrase 12, Carbonic anhydrase 2, Carbonic anhydrase 4, Carbonic anhydrase 7, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, P22748, P43166, and Q16790
DOI: 10.7270/q2tx3jsf
title: BindingDB Entry 50008819: Optimization of novel reversible Bruton's tyrosine kinase inhibitors identified using Tethering-fragment-based screens.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 3A4, Cytoplasmic tyrosine-protein kinase BMX, Tyrosine-protein kinase BTK, Tyrosine-protein kinase ITK/TSK, Tyrosine-protein kinase TXK, and Tyrosine-protein kinase Tec, Uniprot P05177, P08684, P11712, P33261, P42680, P42681, P51813, Q06187, and Q08881
DOI: 10.7270/q2tx3jtw
title: BindingDB Entry 50009145: Optimization and anti-inflammatory evaluation of methyl gallate derivatives as a myeloid differentiation protein 2 inhibitor.

description: Small molecule binding data for protein Lymphocyte antigen 96, Uniprot Q9Y6Y9
DOI: 10.7270/q2tx3jvb
title: BindingDB Entry 50009779: Design and synthesis of novel dual-cyclic RGD peptides for α

description: Small molecule binding data for protein Integrin alpha-V/beta-3, Uniprot P05106 and P06756
DOI: 10.7270/q2tx3jws
title: BindingDB Entry 50010354: Optimization of cyclic sulfamide derivatives as 11β-hydroxysteroid dehydrogenase 1 inhibitors for the potential treatment of ischemic brain injury.

description: Small molecule binding data for protein 11-beta-hydroxysteroid dehydrogenase 1, Uniprot P28845 and P50172
DOI: 10.7270/q2tx3jx7
title: BindingDB Entry 50010963: Synthesis, biochemical evaluation, and molecular modeling of organophosphate-coumarin hybrids as potent and selective butyrylcholinesterase inhibitors.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot O42275 and P81908
DOI: 10.7270/q2tx3jzp
title: BindingDB Entry 50011301: Drug Induced Liver Injury (DILI). Mechanisms and Medicinal Chemistry Avoidance/Mitigation Strategies.

description: Small molecule binding data for protein Bile salt export pump, Uniprot O95342
DOI: 10.7270/q2tx3k0j
title: BindingDB Entry 50011597: Design, Synthesis, and Characterization of an Orally Active Dual-Specific ULK1/2 Autophagy Inhibitor that Synergizes with the PARP Inhibitor Olaparib for the Treatment of Triple-Negative Breast Cancer.

description: Small molecule binding data for protein Serine/threonine-protein kinase ULK1 and Serine/threonine-protein kinase ULK2, Uniprot O75385 and Q8IYT8
DOI: 10.7270/q2tx3k10
title: BindingDB Entry 50011936: Design, synthesis and biological evaluation of novel thiohydantoin derivatives as potent androgen receptor antagonists for the treatment of prostate cancer.

description: Small molecule binding data for protein Androgen receptor, Uniprot P10275
DOI: 10.7270/q2tx3k2f
title: BindingDB Entry 50012557: Discovery of BC-01, a novel mutual prodrug (hybrid drug) of ubenimex and fluorouracil as anticancer agent.

description: Small molecule binding data for protein Aminopeptidase N, Uniprot P15144 and P15145
DOI: 10.7270/q2tx3k3w
title: BindingDB Entry 50013195: Design, synthesis, and biological evaluation of 4-benzoylamino-1H-pyrazole-3-carboxamide derivatives as potent CDK2 inhibitors.

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-H/Cyclin-dependent kinase 7, Cyclin-T1/Cyclin-dependent kinase 9, Cyclin-dependent kinase 12, Cyclin-dependent kinase 2/G1/S-specific cyclin-E1, Cyclin-dependent kinase 3/G1/S-specific cyclin-E1, Cyclin-dependent kinase 4/G1/S-specific cyclin-D1, Cyclin-dependent kinase 4/G1/S-specific cyclin-D3, Cyclin-dependent kinase 5, Cyclin-dependent kinase 6/G1/S-specific cyclin-D3, Cyclin-dependent kinase 9, and Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1, Uniprot O60563, P06493, P11802, P14635, P20248, P24385, P24864, P24941, P30281, P50613, P50750, P51946, P51948, Q00526, Q00534, Q00535, and Q9NYV4
DOI: 10.7270/q2tx3k4b
title: BindingDB Entry 50013825: Design, synthesis, and in vitro and in vivo anti-angiogenesis study of a novel vascular endothelial growth factor receptor-2 (VEGFR-2) inhibitor based on 1,2,3-triazole scaffold.

description: Small molecule binding data for protein Vascular endothelial growth factor receptor 2, Uniprot P35968
DOI: 10.7270/q2tx3k5s
title: BindingDB Entry 50014478: Novel Bromodomain Inhibitors for Treating Cancer, Fibrosis, and Inflammatory Disorders.

description: Small molecule binding data for protein Bromodomain-containing protein 4, Uniprot O60885
DOI: 10.7270/q2v127w1
title: BindingDB Entry 9171: LXR agonists and uses thereof

description: Small molecule binding data for protein Oxysterols receptor LXR-alpha and Oxysterols receptor LXR-beta, Uniprot P55055 and Q13133
DOI: 10.7270/q2v127xg
title: BindingDB Entry 9558: Imidazopyrazinones as PDE1 inhibitors

description: Small molecule binding data for protein Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A, Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B, and Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C, Uniprot P54750, Q01064, and Q14123
DOI: 10.7270/q2v127zx
title: BindingDB Entry 9945: Inhibitors of lysine specific demethylase-1

description: Small molecule binding data for protein Lysine-specific histone demethylase 1A, Uniprot O60341
DOI: 10.7270/q2v1280s
title: BindingDB Entry 10332: Heterocyclic compounds for the inhibition of PASK

description: Small molecule binding data for protein PAS domain-containing serine/threonine-protein kinase, Uniprot Q96RG2
DOI: 10.7270/q2v12817
title: BindingDB Entry 10541: HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE

description: Small molecule binding data for protein GTPase KRas [1-169,G12C,C118A], Uniprot P01116
DOI: 10.7270/q2v1282p
title: BindingDB Entry 10719: Amino acid compounds with unbranched linkers and methods of use

description: Small molecule binding data for protein Integrin alpha-V/beta-6, Uniprot P06756 and P18564
DOI: 10.7270/q2v12834
title: BindingDB Entry 10928: 5-5 fused rings as C5a inhibitors

description: Small molecule binding data for protein C5a anaphylatoxin chemotactic receptor 1, Uniprot P21730
DOI: 10.7270/q2v1284k
title: BindingDB Entry 50007219: Adaptable Small Ligand of CYP1 Enzymes for Use in Understanding the Structural Features Determining Isoform Selectivity.

description: Small molecule binding data for protein Cytochrome P450 1A1, Cytochrome P450 1A2, and Cytochrome P450 1B1, Uniprot P04798, P05177, and Q16678
DOI: 10.7270/q2v12851
title: BindingDB Entry 50007839: The past, present and future of potential small-molecule drugs targeting p53-MDM2/MDMX for cancer therapy.

description: Small molecule binding data for protein E3 ubiquitin-protein ligase Mdm2 and Protein Mdm4, Uniprot O15151 and Q00987
DOI: 10.7270/q2v1286g
title: BindingDB Entry 50008446: N-alkyl-hydroxybenzoyl anilide hydroxamates as dual inhibitors of HDAC and HSP90, downregulating IFN-γ induced PD-L1 expression.

description: Small molecule binding data for protein Heat shock protein HSP 90-alpha, Histone deacetylase 1/2/3/4/5/6/7/8/9/11/Polyamine deacetylase HDAC10, Histone deacetylase 11, Histone deacetylase 2, Histone deacetylase 3, Histone deacetylase 4, Histone deacetylase 5, Histone deacetylase 6, Histone deacetylase 7, Histone deacetylase 8, Histone deacetylase 9, NAD-dependent protein deacetylase sirtuin-1, and Polyamine deacetylase HDAC10, Uniprot O15379, P07900, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q96EB6, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2v1287x
title: BindingDB Entry 50009097: Chain-Shortened Myostatin Inhibitory Peptides Improve Grip Strength in Mice.

description: Small molecule binding data for protein Growth/differentiation factor 8, Uniprot O14793
DOI: 10.7270/q2v1288c
title: BindingDB Entry 50009436: Design, synthesis and biological evaluation of a new series of thiazolyl-pyrazolines as dual EGFR and HER2 inhibitors.

description: Small molecule binding data for protein Epidermal growth factor receptor, Insulin receptor, Insulin-like growth factor 1 receptor, Platelet-derived growth factor receptor alpha, Platelet-derived growth factor receptor beta, Receptor tyrosine-protein kinase erbB-2, Receptor tyrosine-protein kinase erbB-4, and Vascular endothelial growth factor receptor 2, Uniprot P00533, P04626, P06213, P08069, P09619, P16234, P35968, and Q15303
DOI: 10.7270/q2v1289t
title: BindingDB Entry 50009726: Discovery of first-in-class thiazole-based dual FFA1/PPARδ agonists as potential anti-diabetic agents.

description: Small molecule binding data for protein Free fatty acid receptor 1, Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor delta, and Peroxisome proliferator-activated receptor gamma, Uniprot O14842, P37231, Q03181, and Q07869
DOI: 10.7270/q2v128b8
title: BindingDB Entry 50010052: Synthesis and biological evaluation of novel tricyclic oxazine and oxazepine fused quinazolines. Part 2: Gefitinib analogs.

description: Small molecule binding data for protein Epidermal growth factor receptor and Receptor tyrosine-protein kinase erbB-2, Uniprot P00533 and P04626
DOI: 10.7270/q2v128cq
title: BindingDB Entry 50010610: Development of Pyrazolo[3,4-

description: Small molecule binding data for protein Serine/threonine-protein kinase Sgk1, Uniprot O00141
DOI: 10.7270/q2v128d5
title: BindingDB Entry 50011247: Design, synthesis and biological evaluation of pyridone-aminal derivatives as MNK1/2 inhibitors.

description: Small molecule binding data for protein MAP kinase-interacting serine/threonine-protein kinase 1 and MAP kinase-interacting serine/threonine-protein kinase 2, Uniprot Q9BUB5 and Q9HBH9
DOI: 10.21942/uva.21884220.v2
title: DataFiles:Molecular Probing of the Stress Activation Volume in Vapor Phase Lubricated Friction

description: This is the data for publication:Molecular Probing of the Stress Activation Volume in Vapor Phase Lubricated Friction Authors: Chao Chun Hsu, Liang Peng, Feng-Chun Hsia, Bart Weber, Daniel Bonn, Albert Manfred Brouwer Please cite the original paper: 10.1021/acsami.3c00789 The repository contains three zip files: 1. Excel Data.zip: The excel files for reproducing all the figures in the article/supporting information Tiff Image files are not included but in the Figures.zip 2. Figures.zip: The original figure files in the article. The Tiff images for reproducing Figure 2 and Figure S4 can be found here. 3. Matlab_file.zip: to reproduce the figures in the article one can run the "plot_all_data.m" in the folder. (Matlab 2021b)
DOI: 10.7270/q2v128fm
title: BindingDB Entry 50011872: Progress toward a Glycoprotein VI Modulator for the Treatment of Thrombosis.

description: Small molecule binding data for protein Platelet glycoprotein VI, Thromboxane A2 receptor, and Tyrosine-protein kinase BTK, Uniprot P21731, P35991, and Q9HCN6
DOI: 10.21942/uva.21884220
title: DataFiles:Molecular Probing of the Stress Activation Volume in Vapor Phase Lubricated Friction

description: This is the data for publication:Molecular Probing of the Stress Activation Volume in Vapor Phase Lubricated Friction Authors: Chao Chun Hsu, Liang Peng, Feng-Chun Hsia, Bart Weber, Daniel Bonn, Albert Manfred Brouwer Please cite the original paper: 10.1021/acsami.3c00789 The repository contains three zip files: 1. Excel Data.zip: The excel files for reproducing all the figures in the article/supporting information Tiff Image files are not included but in the Figures.zip 2. Figures.zip: The original figure files in the article. The Tiff images for reproducing Figure 2 and Figure S4 can be found here. 3. Matlab_file.zip: to reproduce the figures in the article one can run the "plot_all_data.m" in the folder. (Matlab 2021b)
DOI: 10.21942/uva.21884220.v1
title: DataFiles:Molecular Probing of the Stress Activation Volume in Vapor Phase Lubricated Friction

description: The files contain high-resolution images in the manuscript and supplementary information. The raw data files are also included in the archive. To reproduce the figures, one can run the Matlab file. <br> In order to run the Matlab file, please add the Matlab folder to your path. One can open the file 'plot_all_data.m' and click run. It will reproduce the figures in the manuscripts. <br> One can find the raw data in the "Datafile.mat"
DOI: 10.7270/q2v128g2
title: BindingDB Entry 50012215: Optimization and evaluation of novel tetrahydropyrido[4,3-d]pyrimidine derivatives as ATX inhibitors for cardiac and hepatic fibrosis.

description: Small molecule binding data for protein Ectonucleotide pyrophosphatase/phosphodiesterase family member 2, Uniprot Q13822
DOI: 10.7270/q2v128hh
title: BindingDB Entry 50012497: A benzoxazole derivative as an inhibitor of anaerobic choline metabolism by human gut microbiota.

description: Small molecule binding data for protein Choline trimethylamine-lyase, Uniprot Q30W70
DOI: 10.7270/q2v128jz
title: BindingDB Entry 50012833: Design, Synthesis, and Preclinical Evaluation of 3-Methyl-6-(5-thiophenyl)-1,3-dihydro-imidazo[4,5-

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, and Cytochrome P450 3A4, Uniprot P05177, P08684, P10632, P10635, P11712, P33261, and P40989
DOI: 10.7270/q2v128kd
title: BindingDB Entry 50013485: Identification of 2,2-Dimethylbutanoic Acid (HST5040), a Clinical Development Candidate for the Treatment of Propionic Acidemia and Methylmalonic Acidemia.

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, Cytochrome P450 3A5, Solute carrier family 22 member 6, and Solute carrier family 22 member 8, Uniprot P05177, P08684, P10632, P10635, P11712, P20813, P20815, P33261, Q4U2R8, and Q8TCC7
DOI: 10.7270/q2v128mv
title: BindingDB Entry 50014135: Dual Glycolate Oxidase/Lactate Dehydrogenase A Inhibitors for Primary Hyperoxaluria.

description: Small molecule binding data for protein 2-Hydroxyacid oxidase 1, Hydroxyacid oxidase 1, and L-lactate dehydrogenase A chain, Uniprot I3LVF1, P00338, P06151, Q9UJM8, and Q9WU19
DOI: 10.7270/q2v40z7g
title: BindingDB Entry 9140: Modulators of calcium release-activated calcium channel

description: Small molecule binding data for protein Calcium release-activated calcium channel protein 1, Uniprot Q96D31
DOI: 10.7270/q2v40z8x
title: BindingDB Entry 9349: CaMKII inhibitors and uses thereof

description: Small molecule binding data for protein Calcium/calmodulin-dependent protein kinase type II subunit delta, Uniprot Q13557
DOI: 10.7270/q2v40z9c
title: BindingDB Entry 9527: Substituted 3-dialkylaminomethyl-piperidin-4-yl-benzamides and methods of making and using same

description: Small molecule binding data for protein Beta-arrestin-1 and Mu-type opioid receptor, Uniprot P35372 and P49407
DOI: 10.7270/q2v40zbt
title: BindingDB Entry 9736: Aryl ethene derivative and pharmaceutical composition containing same as active ingredient

description: Small molecule binding data for protein Estrogen receptor, Estrogen-related receptor gamma, Steroid hormone receptor ERR1, and Steroid hormone receptor ERR2, Uniprot O95718, P03372, P11474, and P62508
DOI: 10.7270/q2v40zc8
title: BindingDB Entry 10123: Imidazopyridinyl compounds and use thereof for treatment of neurodegenerative disorders

description: Small molecule binding data for protein Leucine-rich repeat serine/threonine-protein kinase 2, Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S], and Tyrosine-protein kinase ABL1, Uniprot P00519 and Q5S007
DOI: 10.7270/q2v40zdq
title: BindingDB Entry 10510: Alpha-hydroxy phenylacetic acid pharmacophore or bioisostere Mcl-1 protein antagonists

description: Small molecule binding data for protein Bcl-2-like protein 11 [51-76]/Induced myeloid leukemia cell differentiation protein Mcl-1 [171-327], Uniprot O43521 and Q07820
DOI: 10.7270/q2v40zf5
title: BindingDB Entry 10897: RIP1 inhibitory compounds and methods for making and using the same

description: Small molecule binding data for protein Receptor-interacting serine/threonine-protein kinase 1, Uniprot Q13546
DOI: 10.7270/q2v40zgm
title: BindingDB Entry 50006908: Design, synthesis and biological evaluation of curcumin analogues as novel LSD1 inhibitors.

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/q2v40zh2
title: BindingDB Entry 50007177: Investigation of the molecular characteristics of bisindole inhibitors as HIV-1 glycoprotein-41 fusion inhibitors.

description: Small molecule binding data for protein Envelope glycoprotein gp160, Uniprot Q6QLK5
DOI: 10.7270/q2v40zjh
title: BindingDB Entry 50007519: Prenylated Stilbenoids Affect Inflammation by Inhibiting the NF-κB/AP-1 Signaling Pathway and Cyclooxygenases and Lipoxygenase.

description: Small molecule binding data for protein Polyunsaturated fatty acid 5-lipoxygenase, Prostaglandin G/H synthase 1, and Prostaglandin G/H synthase 2, Uniprot P05979, P09917, and P35354
DOI: 10.7270/q2v40zkz
title: BindingDB Entry 50008125: Design, synthesis, and biological evaluation of novel benzodiazepine derivatives as anticancer agents through inhibition of tubulin polymerization in vitro and in vivo.

description: Small molecule binding data for protein Tubulin beta chain, Uniprot P02554
DOI: 10.7270/q2v40zmd
title: BindingDB Entry 50008767: Total synthesis of dryocrassin ABBA and its analogues with potential inhibitory activity against drug-resistant neuraminidases.

description: Small molecule binding data for protein Neuraminidase, Uniprot P03468 and P03470
DOI: 10.7270/q2v40znv
title: BindingDB Entry 50009385: Identification of benzo[cd]indol-2(1H)-ones as novel Atg4B inhibitors via a structure-based virtual screening and a novel AlphaScreen assay.

description: Small molecule binding data for protein Cysteine protease ATG4B, Uniprot Q9Y4P1
DOI: 10.7270/q2v40zp9
title: BindingDB Entry 50010002: Cell Active Hydroxylactam Inhibitors of Human Lactate Dehydrogenase with Oral Bioavailability in Mice.

description: Small molecule binding data for protein L-lactate dehydrogenase A chain and L-lactate dehydrogenase B chain, Uniprot P00338 and P07195
DOI: 10.7270/q2v40zqr
title: BindingDB Entry 50010305: Discovery of (S)-6-methoxy-chroman-3-carboxylic acid (4-pyridin-4-yl-phenyl)-amide as potent and isoform selective ROCK2 inhibitors.

description: Small molecule binding data for protein Rho-associated protein kinase 1 and Rho-associated protein kinase 2, Uniprot O75116 and Q13464
DOI: 10.7270/q2v40zr6
title: BindingDB Entry 50010559: In Vitro Activation of Cytochrome P450 46A1 (CYP46A1) by Efavirenz-Related Compounds.

description: Small molecule binding data for protein Cholesterol 24-hydroxylase, Uniprot Q9Y6A2
DOI: 10.7270/q2v40zsn
title: BindingDB Entry 50010918: Development of Novel AKR1C3 Inhibitors as New Potential Treatment for Castration-Resistant Prostate Cancer.

description: Small molecule binding data for protein Aldo-keto reductase family 1 member C1, Aldo-keto reductase family 1 member C2, Aldo-keto reductase family 1 member C3, Aldo-keto reductase family 1 member C4, Androgen receptor, and Carbonyl reductase [NADPH] 1, Uniprot P10275, P16152, P17516, P42330, P52895, and Q04828
DOI: 10.7270/q2v40zt3
title: BindingDB Entry 50011543: Discovery of 9-Cyclopropylethynyl-2-((

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, G-protein coupled receptor 84, and cAMP-specific 3',5'-cyclic phosphodiesterase 4A, Uniprot P05177, P08684, P10635, P11712, P27815, P33261, Q8CIM5, and Q9NQS5
DOI: 10.7270/q2v40zvj
title: BindingDB Entry 50012161: Novel 2,7-Diazaspiro[4,4]nonane Derivatives to Inhibit Mouse and Human Osteoclast Activities and Prevent Bone Loss in Ovariectomized Mice without Affecting Bone Formation.

description: Small molecule binding data for protein Dedicator of cytokinesis protein 5, Uniprot B2RY04 and Q9H7D0
DOI: 10.7270/q2v40zw0
title: BindingDB Entry 50012779: The discovery and evaluation of 3-amino-2(1H)-pyrazinones as a novel series of selective p38α MAP kinase 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, MAP kinase-activated protein kinase 2, Mitogen-activated protein kinase 11, Mitogen-activated protein kinase 12, Mitogen-activated protein kinase 13, Mitogen-activated protein kinase 14, and Ribosomal protein S6 kinase alpha-5, Uniprot O15264, O75582, P05177, P08684, P10635, P11712, P33261, P40989, P49137, P53778, Q15759, and Q16539
DOI: 10.7270/q2v40zxf
title: BindingDB Entry 50013143: Dioxotriazine derivatives as a new class of P2X

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, P2X purinoceptor 1, P2X purinoceptor 2/3, P2X purinoceptor 3, P2X purinoceptor 4, and P2X purinoceptor 7, Uniprot P05177, P08684, P10635, P11712, P33261, P51575, P56373, Q99571, Q99572, and Q9UBL9