cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2sb49nz
title: BindingDB Entry 50015436: Discovery of AS-1763: A Potent, Selective, Noncovalent, and Orally Available Inhibitor of Bruton's Tyrosine Kinase.

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, Cytoplasmic tyrosine-protein kinase BMX, Epithelial discoidin domain-containing receptor 1, Muscle, skeletal receptor tyrosine-protein kinase, Potassium voltage-gated channel subfamily H member 2, Proto-oncogene tyrosine-protein kinase Src, Tyrosine-protein kinase BTK, Tyrosine-protein kinase ITK/TSK, and Tyrosine-protein kinase Tec, Uniprot O15146, P05177, P08684, P10632, P10635, P11712, P12931, P20813, P33261, P42680, P51813, Q06187, Q08345, Q08881, and Q12809
DOI: 10.7270/q2nk3jx7
title: BindingDB Entry 50015437: Discovery of a Novel BCL-X

description: Small molecule binding data for protein Apoptosis regulator Bcl-2 and Bcl-2-like protein 1, Uniprot P10415 and Q07817
DOI: 10.7270/q2ht2t7c
title: BindingDB Entry 50015438: Discovery and Preclinical Pharmacology of an Oral Bromodomain and Extra-Terminal (BET) Inhibitor Using Scaffold-Hopping and Structure-Guided Drug Design.

description: Small molecule binding data for protein Bromodomain-containing protein 2, Bromodomain-containing protein 3, Bromodomain-containing protein 4, Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, and Potassium voltage-gated channel subfamily H member 2, Uniprot O60885, P05177, P08684, P10635, P11712, P25440, P33261, Q12809, and Q15059
DOI: 10.7270/q2d222js
title: BindingDB Entry 50015439: Discovery of bilirubin as novel P2X7R antagonist with anti-tumor activity.

description: Small molecule binding data for protein P2X purinoceptor 7, Uniprot Q99572
DOI: 10.7270/q28919sm
title: BindingDB Entry 50015443: 1,5,6,7-Tetrahydro-4H-indazol-4-ones as human neutrophil elastase (HNE) inhibitors.

description: Small molecule binding data for protein Neutrophil elastase, Uniprot P08246
DOI: 10.7270/q24m98fm
title: BindingDB Entry 50015444: Discovery and structure - activity relationship exploration of pyrazolo[1,5-a]pyrimidine derivatives as potent FLT3-ITD inhibitors.

description: Small molecule binding data for protein Receptor-type tyrosine-protein kinase FLT3 [K633Q], Uniprot P36888
DOI: 10.7270/q20v8hqw
title: BindingDB Entry 50015445: Searching for an ideal SERM: Mining tamoxifen structure-activity relationships.

description: Small molecule binding data for protein Estrogen receptor, Uniprot P03372
DOI: 10.7270/q2w38179
title: BindingDB Entry 50015446: Shining light on the histamine H

description: Small molecule binding data for protein Histamine H2 receptor, Uniprot P25021
DOI: 10.7270/q2rb78hk
title: BindingDB Entry 50015447: Design, synthesis, and structure-activity relationship of PD-1/PD-L1 inhibitors with a benzo[d]isoxazole scaffold.

description: Small molecule binding data for protein Programmed cell death 1 ligand/protein 1, Uniprot Q15116 and Q9NZQ7
DOI: 10.7270/q2mk6hsv
title: BindingDB Entry 50015450: Novel Electrophilic Warhead Targeting a Triple-Negative Breast Cancer Driver in Live Cells Revealed by "Inverse Drug Discovery".

description: Small molecule binding data for protein Glutathione S-transferase P, Uniprot P09211
DOI: 10.7270/q2gt5s30
title: BindingDB Entry 50015451: Design, synthesis, and pharmacological profiling of cannabinoid 1 receptor allosteric modulators: Preclinical efficacy of C2-group GAT211 congeners for reducing intraocular pressure.

description: Small molecule binding data for protein Cannabinoid receptor 1, Uniprot P21554 and P47746
DOI: 10.7270/q2c53qrf
title: BindingDB Entry 50015452: Discovery of 2-(Ortho-Substituted Benzyl)-Indole Derivatives as Potent and Orally Bioavailable RORγ Agonists with Antitumor Activity.

description: Small molecule binding data for protein Nuclear receptor ROR-gamma, Uniprot P51449
DOI: 10.7270/q27d302z
title: BindingDB Entry 50015453: Discovery of Umibecestat (CNP520): A Potent, Selective, and Efficacious β-Secretase (BACE1) Inhibitor for the Prevention of Alzheimer's Disease.

description: Small molecule binding data for protein Amyloid-beta precursor protein, Beta-secretase 1, Beta-secretase 2, Cathepsin D, Cathepsin E, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, and Potassium voltage-gated channel subfamily H member 2, Uniprot P05067, P07339, P08684, P10635, P11712, P14091, P56817, Q12809, and Q9Y5Z0
DOI: 10.7270/q23n27b7
title: BindingDB Entry 50015456: Development of BromoTag: A "Bump-and-Hole"-PROTAC System to Induce Potent, Rapid, and Selective Degradation of Tagged Target Proteins.

description: Small molecule binding data for protein von Hippel-Lindau disease tumor suppressor, Uniprot P40337
DOI: 10.7270/q2zw1qvj
title: BindingDB Entry 50015457: Bradykinin-Potentiating Peptide-Paclitaxel Conjugate Directed at Ectopically Expressed Angiotensin-Converting Enzyme in Triple-Negative Breast Cancer.

description: Small molecule binding data for protein Angiotensin-converting enzyme, Uniprot P12821
DOI: 10.7270/q2v4104x
title: BindingDB Entry 50015458: Germacrane sesquiterpenes from leaves of Eupatorium chinense inhibit protein tyrosine phosphatase.

description: Small molecule binding data for protein Maltase-glucoamylase, Tyrosine-protein phosphatase non-receptor type 1, and Tyrosine-protein phosphatase non-receptor type 2, Uniprot O43451, P17706, and P18031
DOI: 10.7270/q2qc07fn
title: BindingDB Entry 50015459: Design, synthesis and biological evaluation of novel aminopyrazole- and 7-azaindole-based Nek1 inhibitors and their effects on zebrafish kidney development.

description: Small molecule binding data for protein Serine/threonine-protein kinase Nek1, Uniprot Q96PY6
DOI: 10.7270/q2kk9grt
title: BindingDB Entry 50015460: Discovery of Quinazoline-2,4(1

description: Small molecule binding data for protein Poly [ADP-ribose] polymerase 1 and Poly [ADP-ribose] polymerase 2, Uniprot P09874 and Q9UGN5
DOI: 10.7270/q2fx7fcx
title: BindingDB Entry 50015464: C-terminal modified Enkephalin-like tetrapeptides with enhanced affinities at the kappa opioid receptor and monoamine transporters.

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, Mu-type opioid receptor, Sodium-dependent dopamine transporter, Sodium-dependent noradrenaline transporter, and Sodium-dependent serotonin transporter, Uniprot P23975, P31645, P33535, P41143, P41145, and Q01959
DOI: 10.7270/q2b56pnh
title: BindingDB Entry 50015465: Macrocyclic BACE1 inhibitors with hydrophobic cross-linked structures: Optimization of ring size and ring structure.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q26d5xxs
title: BindingDB Entry 50015467: Targeting of the FOXM1 Oncoprotein by E3 Ligase-Assisted Degradation.

description: Small molecule binding data for protein Forkhead box protein M1, Uniprot Q08050
DOI: 10.7270/q22n566v
title: BindingDB Entry 50015468: Discovery of Potent and Novel Dual PARP/BRD4 Inhibitors for Efficient Treatment of Pancreatic Cancer.

description: Small molecule binding data for protein Bromodomain testis-specific protein, Bromodomain-containing protein 1, Bromodomain-containing protein 2, Bromodomain-containing protein 3, Bromodomain-containing protein 4, Histone acetyltransferase p300, Poly [ADP-ribose] polymerase 1, Poly [ADP-ribose] polymerase 2, and Serine/threonine-protein kinase PLK1, Uniprot O60885, O95696, P09874, P25440, P53350, Q09472, Q15059, Q58F21, and Q9UGN5
DOI: 10.7270/q2xw4pq5
title: BindingDB Entry 50015469: LipE guided discovery of isopropylphenyl pyridazines as pantothenate kinase modulators.

description: Small molecule binding data for protein Pantothenate kinase 3, Uniprot Q9H999
DOI: 10.7270/q2t43z05
title: BindingDB Entry 50015470: Structure-Based Design of Dual Partial Peroxisome Proliferator-Activated Receptor γ Agonists/Soluble Epoxide Hydrolase Inhibitors.

description: Small molecule binding data for protein Bifunctional epoxide hydrolase 2 and Peroxisome proliferator-activated receptor gamma, Uniprot P34913, P34914, and P37231
DOI: 10.7270/q2pc3698
title: BindingDB Entry 50015471: Structure-activity relationship around PI-2620 highlights the importance of the nitrogen atom position in the tricyclic core.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A and Microtubule-associated protein tau, Uniprot P10636 and Q64133
DOI: 10.7270/q2jq14xz
title: BindingDB Entry 50015474: Identification of novel influenza polymerase PB2 inhibitors using virtual screening approach and molecular dynamics simulation analysis of active compounds.

description: Small molecule binding data for protein Polymerase basic protein 2, Uniprot P03428
DOI: 10.7270/q2dz0d73
title: BindingDB Entry 50015475: Design, Synthesis, and Evaluation of Potent, Selective, and Bioavailable AKT Kinase Degraders.

description: Small molecule binding data for protein RAC-alpha serine/threonine-protein kinase, RAC-beta serine/threonine-protein kinase, and RAC-gamma serine/threonine-protein kinase, Uniprot P31749, P31751, and Q9Y243
DOI: 10.7270/q2959ngp
title: BindingDB Entry 50015476: Design, Synthesis, and Biological Evaluation of a Novel Series of Teriflunomide Derivatives as Potent Human Dihydroorotate Dehydrogenase Inhibitors for Malignancy Treatment.

description: Small molecule binding data for protein Dihydroorotate dehydrogenase (quinone), mitochondrial, Uniprot Q02127
DOI: 10.7270/q25d8wrz
title: BindingDB Entry 50015477: Discovery of Novel Dual-Target Inhibitor of Bromodomain-Containing Protein 4/Casein Kinase 2 Inducing Apoptosis and Autophagy-Associated Cell Death for Triple-Negative Breast Cancer Therapy.

description: Small molecule binding data for protein Bromodomain testis-specific protein, Bromodomain-containing protein 2, Bromodomain-containing protein 3, Bromodomain-containing protein 4, Casein kinase I isoform alpha/delta/epsilon/gamma-1/gamma-2, and Casein kinase II subunit alpha 3, Uniprot O60885, P25440, P48729, P48730, P49674, P78368, Q15059, Q58F21, Q8NEV1, and Q9HCP0
DOI: 10.7270/q21n8511
title: BindingDB Entry 50015481: Nanoparticular Inhibitors of Flavivirus Proteases from Zika, West Nile and Dengue Virus Are Cell-Permeable Antivirals.

description: Small molecule binding data for protein Genome polyprotein and Nonstructural protein 3, Uniprot A0A024AXB9, P06935, and P29990
DOI: 10.7270/q2ww7nks
title: BindingDB Entry 50015488: Discovery of Acyl-sulfonamide Na

description: Small molecule binding data for protein Cytochrome P450 3A4, Sodium channel protein type 1 subunit alpha, Sodium channel protein type 2 subunit alpha, Sodium channel protein type 4 subunit alpha, Sodium channel protein type 5 subunit alpha, Sodium channel protein type 7 subunit alpha, and Sodium channel protein type 8 subunit alpha, Uniprot P08684, P35498, P35499, Q01118, Q14524, Q99250, and Q9UQD0
DOI: 10.7270/q2s46wwt
title: BindingDB Entry 50015489: Conformational Constraint between Aromatic Residue Side Chains in the "Message" Sequence of the Peptide Arodyn Using Ring Closing Metathesis Results in a Potent and Selective Kappa Opioid Receptor Antagonist.

description: Small molecule binding data for protein Kappa-type opioid receptor and Mu-type opioid receptor, Uniprot P35372 and P41145
DOI: 10.7270/q2ng4vkt
title: BindingDB Entry 50015490: Structure-Activity Relationship Studies on Oxazolo[3,4-

description: Small molecule binding data for protein Neuropeptide S receptor, Uniprot Q6W5P4
DOI: 10.7270/q2hq43vg
title: BindingDB Entry 50015491: Tetrahydrofuran-Based Transient Receptor Potential Ankyrin 1 (TRPA1) Antagonists: Ligand-Based Discovery, Activity in a Rodent Asthma Model, and Mechanism-of-Action via Cryogenic Electron Microscopy.

description: Small molecule binding data for protein Cytochrome P450 2D6 and Cytochrome P450 3A4, Uniprot P08684 and P10635
DOI: 10.7270/q2cz3c3q
title: BindingDB Entry 50015492: Design, Synthesis, and Structural Characterization of Lysine Covalent BH3 Peptides Targeting Mcl-1.

description: Small molecule binding data for protein Bcl-2-related protein A1 and Induced myeloid leukemia cell differentiation protein Mcl-1, Uniprot Q07820 and Q16548
DOI: 10.7270/q2862mc9
title: BindingDB Entry 50015495: Synthesis and Characterization of the Novel Rodent-Active and CNS-Penetrant P2X7 Receptor Antagonist Lu AF27139.

description: Small molecule binding data for protein P2X purinoceptor 7, Uniprot Q64663, Q99572, and Q9Z1M0
DOI: 10.7270/q24f1vnk
title: BindingDB Entry 50015496: Sustainable Drug Discovery of Multi-Target-Directed Ligands for Alzheimer's Disease.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P06276 and P22303
DOI: 10.7270/q20p13x7
title: BindingDB Entry 50015498: Synthesis of the Potent, Selective, and Efficacious β-Secretase (BACE1) Inhibitor NB-360.

description: Small molecule binding data for protein Amyloid-beta precursor protein, Beta-secretase 1, Beta-secretase 2, Cathepsin D, Cathepsin E, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, and Potassium voltage-gated channel subfamily H member 2, Uniprot P05067, P07339, P08684, P10635, P11712, P14091, P56817, Q12809, and Q9Y5Z0
DOI: 10.7270/q2vx0mfz
title: BindingDB Entry 50015499: Structural Determinants for the Mode of Action of Imidazopyridine DS2 at δ-Containing γ-Aminobutyric Acid Type A Receptors.

description: Small molecule binding data for protein Gamma-aminobutyric acid receptor subunit alpha-4/beta-1/delta, Uniprot O14764, P18505, and P48169
DOI: 10.7270/q2r78k4q
title: BindingDB Entry 50015503: Engineered Conotoxin Differentially Blocks and Discriminates Rat and Human α7 Nicotinic Acetylcholine Receptors.

description: Small molecule binding data for protein Neuronal acetylcholine receptor subunit alpha-10/alpha-9, Neuronal acetylcholine receptor subunit alpha-2/beta-4, Neuronal acetylcholine receptor subunit alpha-3/alpha-6/beta-4, Neuronal acetylcholine receptor subunit alpha-3/beta-4, Neuronal acetylcholine receptor subunit alpha-4/beta-2, Neuronal acetylcholine receptor subunit alpha-4/beta-4, and Neuronal acetylcholine receptor subunit alpha-7, Uniprot P04757, P09483, P12389, P12390, P12392, P30926, P32297, P36544, P43144, Q05941, Q15825, and Q9JLB5
DOI: 10.7270/q2mg7tff
title: BindingDB Entry 50015506: Macrocyclic Peptides that Selectively Inhibit the

description: Small molecule binding data for protein Proteasome subunit beta type-10, Proteasome subunit beta type-5, and Proteasome subunit beta type-8, Uniprot P28062, P28074, and P40306
DOI: 10.7270/q2gq72pn
title: BindingDB Entry 50015509: Design and synthesis of Grp94 selective inhibitors based on Phe199 induced fit mechanism and their anti-inflammatory effects.

description: Small molecule binding data for protein Endoplasmin and Heat shock protein HSP 90-alpha, Uniprot P07900, P14625, and P41148
DOI: 10.7270/q2bz69zx
title: BindingDB Entry 50015511: Design, Optimization, and Structural Characterization of an Apoptosis-Inducing Factor Peptide Targeting Human Cyclophilin A to Inhibit Apoptosis Inducing Factor-Mediated Cell Death.

description: Small molecule binding data for protein Peptidyl-prolyl cis-trans isomerase A, Uniprot P62937
DOI: 10.7270/q2765k7x
title: BindingDB Entry 50015512: ω-Functionalized Lipid Prodrugs of HIV NtRTI Tenofovir with Enhanced Pharmacokinetic Properties.

description: Small molecule binding data for protein Cytochrome P450 2D6 and Cytochrome P450 3A4, Uniprot P08684 and P10635
DOI: 10.7270/q23f4tjn
title: BindingDB Entry 50015513: Discovery of Novel Acetamide-Based Heme Oxygenase-1 Inhibitors with Potent

description: Small molecule binding data for protein Cytochrome P450 2D6, Cytochrome P450 3A4, Heme oxygenase 1, Heme oxygenase 2, and Potassium voltage-gated channel subfamily H member 2, Uniprot P06762, P08684, P10635, P23711, and Q12809
DOI: 10.7270/q2zp4b19
title: BindingDB Entry 50015514: Sophoraflavanone G Resensitizes ABCG2-Overexpressing Multidrug-Resistant Non-Small-Cell Lung Cancer Cells to Chemotherapeutic Drugs.

description: Small molecule binding data for protein Broad substrate specificity ATP-binding cassette transporter ABCG2, Uniprot Q9UNQ0
DOI: 10.7270/q2v128q6
title: BindingDB Entry 50015516: Cysteine derivatives as acetyl lysine mimics to inhibit zinc-dependent histone deacetylases for treating cancer.

description: Small molecule binding data for protein Histone deacetylase, Histone deacetylase 1, Histone deacetylase 2, Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2), Histone deacetylase 4, Histone deacetylase 5, Histone deacetylase 6, Histone deacetylase 7, Histone deacetylase 8, and Histone deacetylase 9, Uniprot O15379, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, Q9UQL6, and Q9Y618
DOI: 10.7270/q2q81j0w
title: BindingDB Entry 50015517: α/Sulfono-γ-AApeptide Hybrid Analogues of Glucagon with Enhanced Stability and Prolonged In Vivo Activity.

description: Small molecule binding data for protein Glucocorticoid receptor, Uniprot P04150
DOI: 10.7270/q2kh0s7q
title: BindingDB Entry 50015518: Discovery of novel BTK PROTACs for B-Cell lymphomas.

description: Small molecule binding data for protein Tyrosine-protein kinase BTK, Uniprot Q06187
DOI: 10.7270/q2fr01hc
title: BindingDB Entry 50015521: Design, synthesis, and biological evaluation of novel Bcr-Abl

description: Small molecule binding data for protein Breakpoint cluster region protein/Tyrosine-protein kinase ABL1, Uniprot P00519 and P11274
DOI: 10.7270/q29z98s3
title: BindingDB Entry 50015522: 4-Acyl Pyrrole Capped HDAC Inhibitors: A New Scaffold for Hybrid Inhibitors of BET Proteins and Histone Deacetylases as Antileukemia Drug Leads.

description: Small molecule binding data for protein Bromodomain-containing protein 2, Bromodomain-containing protein 3, Bromodomain-containing protein 4, Bromodomain-containing protein 7, Histone deacetylase 1, Histone deacetylase 2, Histone deacetylase 3, and Histone deacetylase 6, Uniprot O15379, O60885, P25440, Q13547, Q15059, Q92769, Q9NPI1, and Q9UBN7
DOI: 10.7270/q2668j23
title: BindingDB Entry 50015523: Synthesis of small molecules targeting paclitaxel-induced MyD88 expression in triple-negative breast cancer cell lines.

description: Small molecule binding data for protein Lymphocyte antigen 96, Uniprot Q9Y6Y9
DOI: 10.7270/q22f7sbc
title: BindingDB Entry 50015526: Synthesis of Norgestomet and its 17β-isomer and evaluation of their agonistic activities against progesterone receptor.

description: Small molecule binding data for protein Progesterone receptor, Uniprot P06401
DOI: 10.7270/q2xs6097
title: BindingDB Entry 50015529: Effect of phenylurea hydroxamic acids on histone deacetylase and VEGFR-2.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 2, Histone deacetylase 6, Histone deacetylase 8, and Vascular endothelial growth factor receptor 2, Uniprot P35968, Q13547, Q92769, Q9BY41, and Q9UBN7
DOI: 10.7270/q2t157kt
title: BindingDB Entry 50015534: Discovery of a Highly Potent and Selective Degrader Targeting Hematopoietic Prostaglandin D Synthase via In Silico Design.

description: Small molecule binding data for protein Hematopoietic prostaglandin D synthase, Uniprot O60760
DOI: 10.7270/q2p84gtn
title: BindingDB Entry 50015537: Photosensitive and Photoswitchable TRPA1 Agonists Optically Control Pain through Channel Desensitization.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily A member 1, Uniprot O75762
DOI: 10.7270/q2jh3r3b
title: BindingDB Entry 50015538: Characterization of an aromatic trifluoromethyl ketone as a new warhead for covalently reversible kinase inhibitor design.

description: Small molecule binding data for protein Fibroblast growth factor receptor 1, Fibroblast growth factor receptor 2, Fibroblast growth factor receptor 3, Fibroblast growth factor receptor 4, and Tyrosine-protein kinase JAK3, Uniprot P11362, P21802, P22455, P22607, and P52333
DOI: 10.7270/q2dr30df
title: BindingDB Entry 50015539: Histamine H

description: Small molecule binding data for protein Amyloid-beta precursor protein and Histamine H3 receptor, Uniprot P05067 and Q9Y5N1
DOI: 10.7270/q29027p1
title: BindingDB Entry 50015540: Discovery of the Triazolo[1,5-

description: Small molecule binding data for protein Cytochrome P450 3A4, Uniprot P08684
DOI: 10.7270/q2571gxv
title: BindingDB Entry 50015541: Development of Novel VEGFR2 Inhibitors Originating from Natural Product Analogues with Antiangiogenic Impact.

description: Small molecule binding data for protein Vascular endothelial growth factor receptor 2, Uniprot P35968
DOI: 10.7270/q21j9fp6
title: BindingDB Entry 50015543: Discovery of (

description: Small molecule binding data for protein Macrophage colony-stimulating factor 1 receptor, Uniprot P07333 and P09581
DOI: 10.7270/q2ws8z5g
title: BindingDB Entry 50015545: Development of Potent and Selective Agonists for Complement C5a Receptor 1 with In Vivo Activity.

description: Small molecule binding data for protein C3a anaphylatoxin chemotactic receptor and C5a anaphylatoxin chemotactic receptor 1, Uniprot P21730, P30993, and Q16581
DOI: 10.7270/q2s186d0
title: BindingDB Entry 50015546: Targeting a Novel KRAS Binding Site: Application of One-Component Stapling of Small (5-6-mer) Peptides.

description: Small molecule binding data for protein GTPase KRas, Uniprot P01116
DOI: 10.7270/q2n87fp8
title: BindingDB Entry 50015547: Design, Synthesis, Biological Evaluation, and Computational Studies of Novel Fluorinated Candidates as PI3K Inhibitors: Targeting Fluorophilic Binding Sites.

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, and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Uniprot O00329, P42336, and P42338
DOI: 10.7270/q2hh6pzj
title: BindingDB Entry 50015548: Direct evidence of edge-to-face CH/π interaction for PAR-1 thrombin receptor activation.

description: Small molecule binding data for protein Proteinase-activated receptor 1, Uniprot P25116
DOI: 10.7270/q2cr5z8p
title: BindingDB Entry 50015553: Further exploration of the structure-activity relationship of dual soluble epoxide hydrolase/fatty acid amide hydrolase inhibitors.

description: Small molecule binding data for protein Bifunctional epoxide hydrolase 2 and Fatty-acid amide hydrolase 1, Uniprot O00519 and P34913
DOI: 10.7270/q28056jn
title: BindingDB Entry 50015555: Novel methyllycaconitine analogues selective for the α4β2 over α7 nicotinic acetylcholine receptors.

description: Small molecule binding data for protein Neuronal acetylcholine receptor subunit alpha-4/beta-2 and Neuronal acetylcholine receptor subunit alpha-7, Uniprot P09483, P12390, P17787, P43681, and Q05941
DOI: 10.7270/q24b3566
title: BindingDB Entry 50015557: Analogs of TIQ-A as inhibitors of human mono-ADP-ribosylating PARPs.

description: Small molecule binding data for protein Poly [ADP-ribose] polymerase 2, Poly [ADP-ribose] polymerase tankyrase-2, Protein mono-ADP-ribosyltransferase PARP10, Protein mono-ADP-ribosyltransferase PARP14, and Protein mono-ADP-ribosyltransferase PARP15, Uniprot Q460N3, Q460N5, Q53GL7, Q9H2K2, and Q9UGN5
DOI: 10.7270/q20k2dgg
title: BindingDB Entry 50015558: Structure-based drug design of novel and highly potent pyruvate dehydrogenase kinase inhibitors.

description: Small molecule binding data for protein [3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase, mitochondrial, [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial, [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial, and [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial, Uniprot O14874, Q15118, Q15119, and Q16654