cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2m61pqb
title: BindingDB Entry 50009534: Required Immunoproteasome Subunit Inhibition Profile for Anti-Inflammatory Efficacy and Clinical Candidate KZR-616 ((2 S,3 R)- N-(( S)-3-(Cyclopent-1-en-1-yl)-1-(( R)-2-methyloxiran-2-yl)-1-oxopropan-2-yl)-3-hydroxy-3-(4-methoxyphenyl)-2-(( S)-2-(2-morpholinoacetamido)propanamido)propenamide).

description: Small molecule binding data for protein Proteasome subunit beta type-1, Proteasome subunit beta type-10, Proteasome subunit beta type-2, Proteasome subunit beta type-5, Proteasome subunit beta type-8, and Proteasome subunit beta type-9, Uniprot O09061, O35955, O55234, P20618, P28062, P28063, P28065, P28074, P28076, P40306, P49721, and Q9R1P3
DOI: 10.7270/q2m61prs
title: BindingDB Entry 50010132: EC18 as a Tool To Understand the Role of HCN4 Channels in Mediating Hyperpolarization-Activated Current in Tissues.

description: Small molecule binding data for protein Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 1, Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2, and Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 4, Uniprot O70507, O88703, O88704, and Q9Y3Q4
DOI: 10.7270/q2m61ps7
title: BindingDB Entry 50010710: Design, synthesis and biological evaluation of HIV-1 protease inhibitors with morpholine derivatives as P2 ligands in combination with cyclopropyl as P1' ligand.

description: Small molecule binding data for protein Gag-Pol polyprotein [489-587], Uniprot P04585
DOI: 10.7270/q2m61ptp
title: BindingDB Entry 50011342: Immobilized Metal Affinity Chromatography as a Drug Discovery Platform for Metalloenzyme Inhibitors.

description: Small molecule binding data for protein Polyunsaturated fatty acid 5-lipoxygenase, Uniprot P09917
DOI: 10.7270/q2m61pv4
title: BindingDB Entry 50011678: Sigma-1 and Sigma-2 Receptor Modulators as Potential Therapeutics for Alzheimer's Disease.

description: Small molecule binding data for protein Sigma intracellular receptor 2 and Sigma non-opioid intracellular receptor 1, Uniprot Q5BJF2 and Q99720
DOI: 10.7270/q2m61pwk
title: BindingDB Entry 50011982: Discovery of a Novel Series of Pyridone-Based EP3 Antagonists for the Treatment of Type 2 Diabetes.

description: Small molecule binding data for protein Prostaglandin E2 receptor EP3 subtype, Uniprot P34980 and P43115
DOI: 10.7270/q2m61px1
title: BindingDB Entry 50012297: Discovery of methoxy-naphthyl linked N-(1-benzylpiperidine) benzamide as a blood-brain permeable dual inhibitor of acetylcholinesterase and butyrylcholinesterase.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot O42275, P22303, and P81908
DOI: 10.7270/q2m61pzg
title: BindingDB Entry 50012597: Identification of a Potential Antimalarial Drug Candidate from a Series of 2-Aminopyrazines by Optimization of Aqueous Solubility and Potency across the Parasite Life Cycle.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Uniprot P40989
DOI: 10.7270/q2m61q0b
title: BindingDB Entry 50012926: Exception That Proves the Rule: Investigation of Privileged Stereochemistry in Designing Dopamine D

description: Small molecule binding data for protein D(1A) dopamine receptor, D(2) dopamine receptor, D(3) dopamine receptor, and Mu-type opioid receptor, Uniprot P14416, P21728, P35372, and P35462
DOI: 10.7270/q2m61q1s
title: BindingDB Entry 50013566: Identification of N-phenyl-2-(phenylsulfonyl)acetamides/propanamides as new SLC-0111 analogues: Synthesis and evaluation of the carbonic anhydrase inhibitory activities.

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/q2m61q27
title: BindingDB Entry 50014236: Discovery of High-Affinity Inhibitors of the BPTF Bromodomain.

description: Small molecule binding data for protein Nucleosome-remodeling factor subunit BPTF, Uniprot Q12830
DOI: 10.7270/q2m90cq8
title: BindingDB Entry 9196: Pyrimidine derivative and use thereof

description: Small molecule binding data for protein ALK tyrosine kinase receptor and ALK tyrosine kinase receptor [L1196M], Uniprot Q9UM73
DOI: 10.7270/q2m90crq
title: BindingDB Entry 9405: Compounds useful as inhibitors of ATR kinase

description: Small molecule binding data for protein Serine/threonine-protein kinase ATR, Uniprot Q13535
DOI: 10.7270/q2m90cs5
title: BindingDB Entry 9792: (S)-2-(1-cyclopropylethyl)-5-(4-methyl-2-((6-(2-oxopyrrolidin-1-yl)pyridin-2-yl)amino) thiazol-5-yl)-7-(methylsulfonyl)isoindolin-1-one as a phosphatidylinositol 3-kinase inhibitor

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform [144-1102], Uniprot O00329, P42336, P42338, and P48736
DOI: 10.7270/q2m90ctm
title: BindingDB Entry 10179: 2,6-dioxaspiro [4,5] decane derivatives and preparation method therefor and pharmaceutical applications thereof

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Mu-type opioid receptor, and Potassium voltage-gated channel subfamily H member 2, Uniprot P04799, P08684, P10635, P11712, P33261, P35372, and Q12809
DOI: 10.7270/q2m90cv2
title: BindingDB Entry 10566: Oxo-tetrahydro-isoquinoline carboxylic acids as STING inhibitors

description: Small molecule binding data for protein Stimulator of interferon genes protein [1-379,R71H,G230A,H232R,R293Q], Uniprot Q86WV6
DOI: 10.7270/q2m90cwh
title: BindingDB Entry 10775: DACOS type NNRTIS amino acid ester derivative, preparation method thereof, pharmaceutical composition, and application thereof

description: Small molecule binding data for protein Gag-Pol polyprotein, Uniprot P0C6F2
DOI: 10.7270/q2m90cxz
title: BindingDB Entry 50006675: DMSO-Perturbing Assay for Identifying Promiscuous Enzyme Inhibitors.

description: Small molecule binding data for protein Beta-lactamase and Chymotrypsinogen A, Uniprot P00766 and P05364
DOI: 10.7270/q2m90czd
title: BindingDB Entry 50006999: Challenges and Opportunities for Therapeutics Targeting the Voltage-Gated Sodium Channel Isoform Na

description: Small molecule binding data for protein Sodium channel protein type 1 subunit alpha, Sodium channel protein type 10 subunit alpha, Sodium channel protein type 11 subunit alpha, Sodium channel protein type 2 subunit alpha, Sodium channel protein type 3 subunit alpha, Sodium channel protein type 4 subunit alpha, Sodium channel protein type 5 subunit alpha, Sodium channel protein type 7 subunit alpha, Sodium channel protein type 8 subunit alpha, and Sodium channel protein type 9 subunit alpha, Uniprot O08562, P35498, P35499, Q01118, Q14524, Q62205, Q6QIY3, Q99250, Q9NY46, Q9UI33, Q9UQD0, and Q9Y5Y9
DOI: 10.7270/q2m90d08
title: BindingDB Entry 50007612: Activity of 2,6,9-trisubstituted purines as potent PDGFRα kinase inhibitors with antileukaemic activity.

description: Small molecule binding data for protein Platelet-derived growth factor receptor alpha, Uniprot P16234
DOI: 10.7270/q2m90d1q
title: BindingDB Entry 50008216: 2-(phenylthio)ethylidene derivatives as anti-Trypanosoma cruzi compounds: Structural design, synthesis and antiparasitic activity.

description: Small molecule binding data for protein Cruzipain, Uniprot P25779
DOI: 10.7270/q2m90d25
title: BindingDB Entry 50008864: Discovery of novel 9H-purin derivatives as dual inhibitors of HDAC1 and CDK2.

description: Small molecule binding data for protein Cyclin-A2/Cyclin-dependent kinase 2 and Histone deacetylase 1, Uniprot P20248, P24941, and Q13547
DOI: 10.7270/q2m90d3m
title: BindingDB Entry 50009480: Discovery of a novel bicyclic compound, DS54360155, as an orally potent analgesic without mu-opioid receptor agonist activity.

description: Small molecule binding data for protein Mu-type opioid receptor, Uniprot P35372
DOI: 10.7270/q2m90d42
title: BindingDB Entry 50009817: Discovery of (S)-1-(1-(4-Chloro-3-fluorophenyl)-2-hydroxyethyl)-4-(2-((1-methyl-1H-pyrazol-5-yl)amino)pyrimidin-4-yl)pyridin-2(1H)-one (GDC-0994), an Extracellular Signal-Regulated Kinase 1/2 (ERK1/2) Inhibitor in Early Clinical Development.

description: Small molecule binding data for protein Cytochrome P450 3A4, Mitogen-activated protein kinase 1, and Mitogen-activated protein kinase 3, Uniprot P08684, P27361, and P28482
DOI: 10.7270/q2m90d5h
title: BindingDB Entry 50010093: Potent selective monoamine oxidase B inhibition by maackiain, a pterocarpan from the roots of Sophora flavescens.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A, Amine oxidase [flavin-containing] A/B, and Amine oxidase [flavin-containing] B, Uniprot P21396, P21397, P21398, P27338, P56560, Q64133, and Q8BW75
DOI: 10.7270/q2m90d6z
title: BindingDB Entry 50010393: Lead Optimization of a Pyrrole-Based Dihydroorotate Dehydrogenase Inhibitor Series for the Treatment of Malaria.

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 3A4/3A5, Dihydroorotate dehydrogenase (quinone), mitochondrial, Potassium voltage-gated channel subfamily A member 5, Sodium channel protein type 5 subunit alpha, and Voltage-dependent L-type calcium channel subunit alpha-1C, Uniprot O35435, P05177, P08684, P10635, P11712, P20815, P22460, P33261, P40989, Q02127, Q13936, Q14524, and Q63707
DOI: 10.7270/q2m90d7d
title: BindingDB Entry 50011007: Potent dual EGFR/Her4 tyrosine kinase inhibitors containing novel (1,2-dithiolan-4-yl)acetamides.

description: Small molecule binding data for protein Epidermal growth factor receptor, Receptor tyrosine-protein kinase erbB-2, Receptor tyrosine-protein kinase erbB-3, and Receptor tyrosine-protein kinase erbB-4, Uniprot P00533, P04626, P21860, and Q15303
DOI: 10.7270/q2m90d8v
title: BindingDB Entry 50011625: Discovery of AZD4573, a Potent and Selective Inhibitor of CDK9 That Enables Short Duration of Target Engagement for the Treatment of Hematological Malignancies.

description: Small molecule binding data for protein CDK-activating kinase assembly factor MAT1/Cyclin-H/Cyclin-dependent kinase 7, Casein kinase I isoform gamma-1, Casein kinase I isoform gamma-2, Cyclin-T1/Cyclin-dependent kinase 9, Cyclin-dependent kinase 12, Cyclin-dependent kinase 2/G1/S-specific cyclin-E1, Cyclin-dependent kinase 3, Cyclin-dependent kinase 4, Cyclin-dependent kinase 5, Cyclin-dependent kinase 6, Cyclin-dependent kinase 9, Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1, Dual specificity tyrosine-phosphorylation-regulated kinase 2, Glycogen synthase kinase-3 alpha, Glycogen synthase kinase-3 beta, and Mitogen-activated protein kinase 8, Uniprot O60563, P06493, P11802, P14635, P24864, P24941, P45983, P49840, P49841, P50613, P50750, P51946, P51948, P78368, Q00526, Q00534, Q00535, Q92630, Q9HCP0, and Q9NYV4
DOI: 10.7270/q2m90d99
title: BindingDB Entry 50012249: Designing an eEF2K-Targeting PROTAC small molecule that induces apoptosis in MDA-MB-231 cells.

description: Small molecule binding data for protein Eukaryotic elongation factor 2 kinase, Uniprot O00418
DOI: 10.7270/q2m90dbr
title: BindingDB Entry 50012875: Discovery and optimization of pyrazolopyrimidine sulfamates as ATG7 inhibitors.

description: Small molecule binding data for protein Ubiquitin-like modifier-activating enzyme ATG7, Uniprot O95352
DOI: 10.7270/q2m90dc6
title: BindingDB Entry 50013233: From Lead to Drug Candidate: Optimization of 3-(Phenylethynyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine Derivatives as Agents for the Treatment of Triple Negative Breast Cancer.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Activated CDC42 kinase 1, Angiopoietin-1 receptor, BDNF/NT-3 growth factors receptor, Cytoplasmic tyrosine-protein kinase BMX, Discoidin domain-containing receptor 2, Ephrin type-A receptor 4, Ephrin type-A receptor 7, Epidermal growth factor receptor, Fibroblast growth factor receptor 1, Fibroblast growth factor receptor 2, Fibroblast growth factor receptor 3, High affinity nerve growth factor receptor, LIM domain kinase 1, Mitogen-activated protein kinase 1, Mitogen-activated protein kinase 11, Mitogen-activated protein kinase 14, Mitogen-activated protein kinase kinase kinase 7, Platelet-derived growth factor receptor alpha, Platelet-derived growth factor receptor beta, Protein-tyrosine kinase 2-beta, Protein-tyrosine kinase 6, Proto-oncogene tyrosine-protein kinase Src, Proto-oncogene tyrosine-protein kinase receptor Ret, RAF proto-oncogene serine/threonine-protein kinase, Receptor tyrosine-protein kinase erbB-2, Receptor tyrosine-protein kinase erbB-4, Ribosomal protein S6 kinase alpha-1, Ribosomal protein S6 kinase alpha-3, Serine/threonine-protein kinase B-raf, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase ABL2, Tyrosine-protein kinase Blk, Tyrosine-protein kinase CSK, Tyrosine-protein kinase FRK, Tyrosine-protein kinase Fyn, Tyrosine-protein kinase HCK, Tyrosine-protein kinase Lck, Tyrosine-protein kinase Lyn, Tyrosine-protein kinase TXK, Tyrosine-protein kinase Yes, Tyrosine-protein kinase receptor TYRO3, Vascular endothelial growth factor receptor 1, and Vascular endothelial growth factor receptor 2, Uniprot O43318, P00519, P00533, P04049, P04626, P04629, P06239, P06241, P07947, P07948, P07949, P08631, P09619, P11362, P12931, P15056, P16234, P17948, P21802, P22607, P28482, P35968, P40989, P41240, P42681, P42684, P42685, P51451, P51812, P51813, P53667, P54764, Q02763, Q06418, Q07912, Q13882, Q14289, Q15303, Q15375, Q15418, Q15759, Q16539, Q16620, and Q16832
DOI: 10.7270/q2m90ddn
title: BindingDB Entry 50013519: Design and Synthesis of Novel Spiro Derivatives as Potent and Reversible Monoacylglycerol Lipase (MAGL) Inhibitors: Bioisosteric Transformation from 3-Oxo-3,4-dihydro-2

description: Small molecule binding data for protein Fatty-acid amide hydrolase 1, Monoacylglycerol lipase ABHD6, and Monoglyceride lipase, Uniprot O00519, O35678, Q99685, and Q9BV23
DOI: 10.7270/q2m90df3
title: BindingDB Entry 50013872: IDO1 and TDO inhibitory evaluation of analogues of the marine pyrroloiminoquinone alkaloids: Wakayin and Tsitsikammamines.

description: Small molecule binding data for protein Indoleamine 2,3-dioxygenase 1, Uniprot P14902
DOI: 10.7270/q2m90dgj
title: BindingDB Entry 50014524: UNC5293, a potent, orally available and highly MERTK-selective inhibitor.

description: Small molecule binding data for protein BDNF/NT-3 growth factors receptor, High affinity nerve growth factor receptor, Maternal embryonic leucine zipper kinase, Mitogen-activated protein kinase kinase kinase kinase 4, NT-3 growth factor receptor, Platelet-derived growth factor receptor alpha, Receptor-type tyrosine-protein kinase FLT3, TRAF2 and NCK-interacting protein kinase, Tyrosine-protein kinase Mer, Tyrosine-protein kinase receptor TYRO3, and Tyrosine-protein kinase receptor UFO, Uniprot O95819, P04629, P16234, P30530, P36888, Q06418, Q12866, Q14680, Q16288, Q16620, and Q9UKE5
DOI: 10.7270/q2mc932j
title: BindingDB Entry 9374: Morphinan derivatives for the treatment of neuropathic pain

description: Small molecule binding data for protein Mu-type opioid receptor, Uniprot P35372
DOI: 10.7270/q2mc9330
title: BindingDB Entry 9583: Difluoroketamide derivatives as HtrA1 inhibitors

description: Small molecule binding data for protein Serine protease HTRA1, Uniprot Q92743
DOI: 10.7270/q2mc934f
title: BindingDB Entry 9761: Dimethyl amino azetidine amides as JAK inhibitors

description: Small molecule binding data for protein Non-receptor tyrosine-protein kinase TYK2, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase JAK3, Uniprot O60674, P23458, P29597, and P52333
DOI: 10.7270/q2mc935w
title: BindingDB Entry 9970: Farnesoid X receptor modulators

description: Small molecule binding data for protein FMR1 autosomal homolog 1 and RNA-binding protein FXR1, Uniprot A0A8I3PAF1, P51114, Q5XI81, and Q61584
DOI: 10.7270/q2mc936b
title: BindingDB Entry 10357: CYCLIN-DEPENDENT KINASE 7 (CDK7) NON-COVALENT INHIBITORS

description: Small molecule binding data for protein CDK-activating kinase assembly factor MAT1/Cyclin-H/Cyclin-dependent kinase 7, Uniprot P50613, P51946, and P51948
DOI: 10.7270/q2mc937s
title: BindingDB Entry 10744: Aryl, heteroaryl, and heterocyclic compounds for treatment of immune and inflammatory disorders

description: Small molecule binding data for protein Complement factor D, Uniprot P00746
DOI: 10.7270/q2mc9387
title: BindingDB Entry 50006946: Discovery of ABBV/GLPG-3221, a Potent Corrector of CFTR for the Treatment of Cystic Fibrosis.

description: Small molecule binding data for protein Cystic fibrosis transmembrane conductance regulator, Uniprot P13569
DOI: 10.7270/q2mc939p
title: BindingDB Entry 50007267: Synthesis and evaluation of isoprenylation-resveratrol dimer derivatives against Alzheimer's disease.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A and Amine oxidase [flavin-containing] B, Uniprot P21397 and P27338
DOI: 10.7270/q2mc93b4
title: BindingDB Entry 50007558: Design, synthesis and biological evaluation of novel chromeno[4,3-c]pyrazol-4(2H)-one derivates containing sulfonamido as potential PI3Kα inhibitors.

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Uniprot O00329, P42336, P42338, and P48736
DOI: 10.7270/q2mc93ck
title: BindingDB Entry 50007873: Design, synthesis and biological evaluation of 3-(imidazo[1,2-a]pyrazin-3-ylethynyl)-2-methylbenzamides as potent and selective pan-tropomyosin receptor kinase (TRK) inhibitors.

description: Small molecule binding data for protein BDNF/NT-3 growth factors receptor, High affinity nerve growth factor receptor, NT-3 growth factor receptor, and Tyrosine-protein kinase ABL1, Uniprot P00519, P04629, Q16288, and Q16620
DOI: 10.7270/q2mc93d1
title: BindingDB Entry 50008161: Discovery of Ziresovir as a Potent, Selective, and Orally Bioavailable Respiratory Syncytial Virus Fusion Protein Inhibitor.

description: Small molecule binding data for protein Fusion glycoprotein F0, Uniprot P03420
DOI: 10.7270/q2mc93gx
title: BindingDB Entry 50009134: Synthesis and biological evaluation of 4-(piperid-3-yl)amino substituted 6-pyridylquinazolines as potent PI3Kδ inhibitors.

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Uniprot O00329, P42336, P42338, and P48736
DOI: 10.7270/q2mc93hc
title: BindingDB Entry 50009771: New Quinolylnitrones for Stroke Therapy: Antioxidant and Neuroprotective ( Z)- N- tert-Butyl-1-(2-chloro-6-methoxyquinolin-3-yl)methanimine Oxide as a New Lead-Compound for Ischemic Stroke Treatment.

description: Small molecule binding data for protein Lipoxygenase, Uniprot Q39829
DOI: 10.7270/q2mc93jt
title: BindingDB Entry 50010344: Synthesis and evaluation of 4-(1,3,4-oxadiazol-2-yl)-benzenesulfonamides as potent carbonic anhydrase inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase 1 and Carbonic anhydrase 2, Uniprot P00915 and P00918
DOI: 10.7270/q2mc93k8
title: BindingDB Entry 50010656: Design of Development Candidate eFT226, a First in Class Inhibitor of Eukaryotic Initiation Factor 4A RNA Helicase.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2 and Eukaryotic initiation factor 4A-I, Uniprot P40989 and P60842
DOI: 10.7270/q2mc93mq
title: BindingDB Entry 50010956: Secondary metabolites from Isodon ternifolius (D. Don) Kudo and their anticancer activity as DNA topoisomerase IB and Tyrosyl-DNA phosphodiesterase 1 inhibitors.

description: Small molecule binding data for protein Tyrosyl-DNA phosphodiesterase 1, Uniprot Q9NUW8
DOI: 10.7270/q2mc93n5
title: BindingDB Entry 50011291: Monomeric Targeted Protein Degraders.

description: Small molecule binding data for protein Androgen receptor, Aurora kinase A, B-cell lymphoma 6 protein, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP, Histone-lysine N-methyltransferase EZH2, Leucine-rich repeat serine/threonine-protein kinase 2, Non-receptor tyrosine-protein kinase TYK2, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase JAK3, Uniprot O14965, O60674, P10275, P23458, P29597, P41182, P52333, P98170, Q13490, Q15910, and Q5S007
DOI: 10.7270/q2mc93pm
title: BindingDB Entry 50011921: Novel indolylarylsulfone derivatives as covalent HIV-1 reverse transcriptase inhibitors specifically targeting the drug-resistant mutant Y181C.

description: Small molecule binding data for protein Reverse transcriptase/RNaseH, Uniprot Q72547
DOI: 10.7270/q2mc93q2
title: BindingDB Entry 50012551: Discovery of the Potent and Selective M1 PAM-Agonist N-[(3R,4S)-3-Hydroxytetrahydro-2H-pyran-4-yl]-5-methyl-4-[4-(1,3-thiazol-4-yl)benzyl]pyridine-2-carboxamide (PF-06767832): Evaluation of Efficacy and Cholinergic Side Effects.

description: Small molecule binding data for protein Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11A, Muscarinic acetylcholine receptor M1, and cGMP-dependent 3',5'-cyclic phosphodiesterase, Uniprot O00408, P11229, and Q9HCR9
DOI: 10.7270/q2mc93rh
title: BindingDB Entry 50013185: Synthesis and evaluation of cyclopentane-based muraymycin analogs targeting MraY.

description: Small molecule binding data for protein Phospho-N-acetylmuramoyl-pentapeptide-transferase, Uniprot O66465
DOI: 10.7270/q2mc93sz
title: BindingDB Entry 50013818: Synthesis and structure-activity studies of novel anhydrohexitol-based Leucyl-tRNA synthetase inhibitors.

description: Small molecule binding data for protein Leucine--tRNA ligase, Uniprot P07813
DOI: 10.7270/q2mc93td
title: BindingDB Entry 50014176: Flavonoid Monomers as Potent, Nontoxic, and Selective Modulators of the Breast Cancer Resistance Protein (ABCG2).

description: Small molecule binding data for protein ATP-dependent translocase ABCB1, Broad substrate specificity ATP-binding cassette transporter ABCG2, and Multidrug resistance-associated protein 1, Uniprot P08183, P33527, and Q9UNQ0
DOI: 10.7270/q2mc93vv
title: BindingDB Entry 50014471: Discovery of 3,5-Dimethyl-4-Sulfonyl-1

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Apoptosis regulator Bcl-2, Bcl-2-like protein 1, Bcl-2-like protein 2, Bcl-2-related protein A1, and Induced myeloid leukemia cell differentiation protein Mcl-1, Uniprot P10415, P40989, Q07817, Q07820, Q16548, and Q92843
DOI: 10.7270/q2mg7sjc
title: BindingDB Entry 9165: Heterocyclic compounds as immunomodulators

description: Small molecule binding data for protein Nuclear factor NF-kappa-B p105 subunit, Programmed cell death 1 ligand 1 [19-238]/protein 1 [25-167], and Tyrosine-protein phosphatase non-receptor type 11, Uniprot P19838, Q06124, Q15116, and Q9NZQ7
DOI: 10.7270/q2mg7skt
title: BindingDB Entry 9552: Bicyclic imidazole derivatives useful for the treatment of renal diseases, cardiovascular diseases and fibrotic diseases

description: Small molecule binding data for protein Cytochrome P450 11B1, mitochondrial and Cytochrome P450 11B2, mitochondrial, Uniprot P15538 and P19099