cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2c53p8r
title: BindingDB Entry 50000826: Synthesis and optimization of 4,5,6,7-tetrahydrooxazolo[4,5-c]pyridines as potent and orally-active metabotropic glutamate receptor 5 negative allosteric modulators.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2A6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, Melanin-concentrating hormone receptor 2/HERG, and Metabotropic glutamate receptor 5, Uniprot A0A090N8Q0, C1ID52, P05177, P08684, P10632, P10635, P11509, P11712, P33261, P41594, Q12809, Q6GRK0, and S5RV20
DOI: 10.7270/q2gx4f05
title: BindingDB Entry 50000824: Quinazoline-1-deoxynojirimycin hybrids as high active dual inhibitors of EGFR andα-glucosidase.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q27d2xkg
title: BindingDB Entry 50000827: Synthesis and biological evaluation of 8-aryl-2-morpholino-7-O-substituted benzo[e][1,3]oxazin-4-ones against DNA-PK, PI3K, PDE3A enzymes and platelet aggregation.

description: Small molecule binding data for protein 3',5'-cyclic phosphodiesterase, DNA-dependent protein kinase, and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform, Uniprot A0A2K8FKV1, O00329, P78527, and Q14432
DOI: 10.7270/q23n25v4
title: BindingDB Entry 50000828: Conjugates of 18β-glycyrrhetinic acid derivatives with 3-(1H-benzo[d]imidazol-2-yl)propanoic acid as Pin1 inhibitors displaying anti-prostate cancer ability.

description: Small molecule binding data for protein Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1, Uniprot Q13526
DOI: 10.7270/q20004jf
title: BindingDB Entry 50000829: Synthesis, pH dependent, plasma and enzymatic stability of bergenin prodrugs for potential use against rheumatoid arthritis.

description: Small molecule binding data for protein Interleukin-6 and Tumor necrosis factor, Uniprot P01375, P05231, Q5STB3, and Q75MH2
DOI: 10.7270/q2v69n2m
title: BindingDB Entry 50000830: Synthesis and biological evaluations of new nitric oxide-anti-inflammatory drug hybrids.

description: Small molecule binding data for protein Prostaglandin E synthase/G/H synthase 2 and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P35354
DOI: 10.7270/q2qf8wbw
title: BindingDB Entry 50000831: Picomolar inhibition ofβ-galactosidase (bovine liver) attributed to loop closure.

description: Small molecule binding data for protein Beta-galactosidase/Glucosylceramidase, Uniprot Q58D55
DOI: 10.7270/q2kp84mj
title: BindingDB Entry 50000832: Discovery of a novel, CNS penetrant M

description: Small molecule binding data for protein Muscarinic acetylcholine receptor and Muscarinic acetylcholine receptor M2 and M4, Uniprot P08173 and P08485
DOI: 10.7270/q2fx7cx8
title: BindingDB Entry 50000833: 1-Phenyl-1H-indole derivatives as a new class of Bcl-2/Mcl-1 dual inhibitors: Design, synthesis, and preliminary biological evaluation.

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 A0A024R2B3, A0A0S2Z3C5, P10415, Q07817, and Q07820
DOI: 10.7270/q26h4kvd
title: BindingDB Entry 50000835: Design and synthesis of benzoacridines as estrogenic and anti-estrogenic agents.

description: Small molecule binding data for protein Baculoviral IAP repeat-containing protein 2/Estrogen receptor, Estrogen receptor, and Estrogen-related receptor gamma, Uniprot F1D8R5, G4XH65, P03372, P62508, Q7LCB3, and Q92731
DOI: 10.7270/q2b56n7q
title: BindingDB Entry 50000834: β-Arrestin biased dopamine D2 receptor partial agonists: Synthesis and pharmacological evaluation.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 2A, D(2) dopamine receptor, D(3) dopamine receptor, D(4) dopamine receptor, Dopamine D1 and D2 receptor, Dopamine receptor, and Sigma non-opioid intracellular receptor 1, Uniprot A0A024R3C5, P08908, P14416, P21728, P21917, P21918, P28223, P35462, Q5ZGX3, and Q99720
DOI: 10.7270/q22r3v43
title: BindingDB Entry 50000837: A prodrug design for improved oral absorption and reduced hepatic interaction.

description: Small molecule binding data for protein Baculoviral IAP repeat-containing protein 2/Estrogen receptor and Carbonic anhydrases; II & IX, Uniprot G4XH65, P00918, P03372, and V9HW21
DOI: 10.7270/q2t72kxc
title: BindingDB Entry 50000839: Development of sulfonamides incorporating phenylacrylamido functionalities as carbonic anhydrase isoforms I, II, IX and XII inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrases; II & IX, Uniprot A0A0S2Z3D0, O43570, P00915, P00918, Q16790, V9HW21, and V9HWE3
DOI: 10.7270/q2z03bn3
title: BindingDB Entry 50000838: Analysis of the binding sites of vitamin D 1α-hydroxylase (CYP27B1) and vitamin D 24-hydroxylase (CYP24A1) for the design of selective CYP24A1 inhibitors: Homology modelling, molecular dynamics simulations and identification of key binding requirements.

description: Small molecule binding data for protein Cytochrome P450 24A1 and Cytochrome P450 27B1, Uniprot O15528 and Q07973
DOI: 10.7270/q2pg1v62
title: BindingDB Entry 50000840: Rational design of conformationally constrained oxazolidinone-fused 1,2,3,4-tetrahydroisoquinoline derivatives as potential PDE4 inhibitors.

description: Small molecule binding data for protein cAMP-specific 3',5'-cyclic phosphodiesterase 4B and cAMP-specific 3',5'-cyclic phosphodiesterase 4D, Uniprot A0A140VJR0, Q07343, Q08499, and X5DNX5
DOI: 10.7270/q2jq13gq
title: BindingDB Entry 50000841: Pyrrolizines: Design, synthesis, anticancer evaluation and investigation of the potential mechanism of action.

description: Small molecule binding data for protein Prostaglandin E synthase/G/H synthase 2 and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P35354
DOI: 10.7270/q2dz0bsf
title: BindingDB Entry 50000844: d-Amino acid mutation of PMI as potent dual peptide inhibitors of p53-MDM2/MDMX interactions.

description: Small molecule binding data for protein MDM2-MDMX and p53-Binding Protein HDMX, Uniprot O15151 and Q00987
DOI: 10.7270/q29889fr
title: BindingDB Entry 50000845: Identification of potent, nonabsorbable agonists of the calcium-sensing receptor for GI-specific administration.

description: Small molecule binding data for protein Calcium sensing receptor and Extracellular calcium-sensing receptor, Uniprot P41180, P48442, and Q9QY96
DOI: 10.7270/q21r6t0q
title: BindingDB Entry 50000849: Novel xanthone-polyamine conjugates as catalytic inhibitors of human topoisomerase IIα.

description: Small molecule binding data for protein Topoisomerase I/II, Uniprot P11388
DOI: 10.7270/q25h7jq1
title: BindingDB Entry 50000846: Design, synthesis and biological evaluation of benzamide and phenyltetrazole derivatives with amide and urea linkers as BCRP inhibitors.

description: Small molecule binding data for protein ATP-binding cassette sub-family G member 2, Uniprot A1LUE4 and Q9UNQ0
DOI: 10.7270/q2x069hq
title: BindingDB Entry 50000850: Discovery of highly potent, selective, covalent inhibitors of JAK3.

description: Small molecule binding data for protein Epidermal growth factor receptor, Macrophage colony-stimulating factor 1 receptor, Non-receptor tyrosine-protein kinase TYK2, Tyrosine-protein kinase BTK, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase JAK3, Uniprot A0A024R7E4, A0A024R7M7, O60674, P00533, P07333, P23458, P29597, P52333, and Q06187
DOI: 10.7270/q2hq42cs
title: BindingDB Entry 50000858: Discovery and optimization of oxadiazole-based FLAP inhibitors.

description: Small molecule binding data for protein 5-lipoxygenase/FLAP, Uniprot P20292
DOI: 10.7270/q2ng4t34
title: BindingDB Entry 50000857: Discovery of N-substituted 7-azaindoles as Pan-PIM kinase inhibitors - Lead series identification - Part II.

description: Small molecule binding data for protein Cytochrome P450 3A, Melanin-concentrating hormone receptor 2/HERG, Serine/threonine-protein kinase pim-1, Serine/threonine-protein kinase pim-2, and Serine/threonine-protein kinase pim-3, Uniprot A0A024QYW7, A0A024RD25, A0A090N8Q0, P08684, P11309, Q12809, Q6GRK0, Q86V86, and Q9P1W9
DOI: 10.7270/q2s75js0
title: BindingDB Entry 50000856: Design and synthesis of novel PRMT1 inhibitors and investigation of their binding preferences using molecular modelling.

description: Small molecule binding data for protein Protein arginine N-methyltransferase 1, Uniprot Q99873
DOI: 10.7270/q28918ct
title: BindingDB Entry 50000860: Development and evaluation of 4-(pyrrolidin-3-yl)benzonitrile derivatives as inhibitors of lysine specific demethylase 1.

description: Small molecule binding data for protein Amine oxidase (flavin-containing) A, Amine oxidase [flavin-containing] B, Lysine-specific histone demethylase 1A, and Melanin-concentrating hormone receptor 2/HERG, Uniprot A0A090N8Q0, O60341, P21397, P27338, Q12809, and Q53YE7
DOI: 10.7270/q2d2213j
title: BindingDB Entry 50000859: Synthesis and evaluation of the NSCLC anti-cancer activity and physical properties of 4-aryl-N-phenylpyrimidin-2-amines.

description: Small molecule binding data for protein Cyclin-T1/Cyclin-dependent-like kinase 5, Uniprot A0A090N7W4 and Q00535
DOI: 10.7270/q24j0hmn
title: BindingDB Entry 50000862: A potent neuromedin U receptor 2-selective alkylated peptide.

description: Small molecule binding data for protein Neuromedin-U receptor 1 and Neuromedin-U receptor 2, Uniprot O55040, Q8BZ39, Q9GZQ4, and Q9HB89
DOI: 10.7270/q20r9rwc
title: BindingDB Entry 50000864: Discovery of novel [1,2,4]triazolo[4,3-a]quinoxaline aminophenyl derivatives as BET inhibitors for cancer treatment.

description: Small molecule binding data for protein Bromodomain-containing protein 4, Uniprot O60885
DOI: 10.7270/q2w098ds
title: BindingDB Entry 50000865: Structure-activity relationship study ofβ-oxidation resistant indole-based 5-oxo-6,8,11,14-eicosatetraenoic acid (5-oxo-ETE) receptor antagonists.

description: Small molecule binding data for protein TG 1019, Uniprot Q8TDS5
DOI: 10.7270/q2r78hp2
title: BindingDB Entry 50000867: Discovery and structure-based design of 4,6-diaminonicotinamides as potent and selective IRAK4 inhibitors.

description: Small molecule binding data for protein Interleukin-1 receptor-associated kinase 4 and Tyrosine-protein kinase JAK3, Uniprot A0A024R7M7, P52333, Q69FE3, and Q9NWZ3
DOI: 10.7270/q2mg7s06
title: BindingDB Entry 50000868: Design, synthesis and biological evaluation of novel histone deacetylase inhibitors incorporating 4-aminoquinazolinyl systems as capping groups.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 6, Histone deacetylase 8, and Melanin-concentrating hormone receptor 2/HERG, Uniprot A0A024QZ26, A0A090N8Q0, Q12809, Q13547, Q6IT96, Q9BY41, and Q9UBN7
DOI: 10.7270/q2gt5qnb
title: BindingDB Entry 50000869: Discovery of N-substituted 7-azaindoles as PIM1 kinase inhibitors - Part I.

description: Small molecule binding data for protein Cell division cycle 7-related protein kinase, Cyclin-dependent kinase 9, Serine/threonine-protein kinase pim-1, Serine/threonine-protein kinase pim-2, and Serine/threonine-protein kinase pim-3, Uniprot A0A024QYW7, A0A024R880, A0A024RD25, A0A384MTU6, O00311, P11309, P50750, Q86V86, and Q9P1W9
DOI: 10.7270/q2c24zxx
title: BindingDB Entry 50000870: PTP1B inhibitors from the seeds of Iris sanguinea and their insulin mimetic activities via AMPK and ACC phosphorylation.

description: Small molecule binding data for protein Protein-tyrosine phosphatase 1B, Uniprot A8K3M3 and P18031
DOI: 10.7270/q279475j
title: BindingDB Entry 50000871: Discovery and SAR of a novel series of Natriuretic Peptide Receptor-A (NPR-A) agonists.

description: Small molecule binding data for protein Atrial natriuretic peptide receptor, Uniprot A0A140VJE6 and P16066
DOI: 10.7270/q23j3gft
title: BindingDB Entry 50000872: Plasma-induced dimerization of phloridzin as a new class of anti-adipogenic agents.

description: Small molecule binding data for protein Pancreatic triacylglycerol lipase, Uniprot P00591
DOI: 10.7270/q2zs300c
title: BindingDB Entry 50000873: Identification of selective 8-(piperidin-4-yloxy)quinoline sulfone and sulfonamide histamine H

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 2B, 5-hydroxytryptamine receptor 2C, Alpha adrenergic receptor 1A and 1B, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, Melanin-concentrating hormone receptor 2/HERG, and Muscarinic acetylcholine receptor M1, Uniprot A0A090N8Q0, C1ID52, P05177, P08684, P10635, P11229, P11712, P28335, P33261, P41595, P43140, Q12809, Q53XZ3, Q6GRK0, and S5RV20
DOI: 10.7270/q2v1278z
title: BindingDB Entry 50000874: Discovery of imidazo[1,2-a]-, [1,2,4]triazolo[4,3-a]-, and [1,2,4]triazolo[1,5-a]pyridine-8-carboxamide negative allosteric modulators of metabotropic glutamate receptor subtype 5.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, Metabotropic glutamate receptor 5, and Sodium-dependent dopamine transporter, Uniprot B2CZC8, C1ID52, P05177, P08684, P10635, P11712, P31424, Q01959, Q6GRK0, and S5RV20
DOI: 10.7270/q2kk9f84
title: BindingDB Entry 50000876: Synthesis of photocaged 6-O-(2-nitrobenzyl)guanosine and 4-O-(2-nitrobenzyl) uridine triphosphates for photocontrol of the RNA transcription reaction.

description: Small molecule binding data for protein DNA-directed RNA polymerase, Uniprot P00573 and Q6WYR7,C1KTT1
DOI: 10.7270/q2q81gj7
title: BindingDB Entry 50000875: Pentacyclic triterpenes asα-glucosidase andα-amylase inhibitors: Structure-activity relationships and the synergism with acarbose.

description: Small molecule binding data for protein Pancreatic alpha-amylase, Uniprot P00690
DOI: 10.7270/q2ft8phz
title: BindingDB Entry 50000878: 9-Substituted acridine derivatives as acetylcholinesterase and butyrylcholinesterase inhibitors possessing antioxidant activity for Alzheimer's disease treatment.

description: Small molecule binding data for protein Carboxylesterase, Cholinesterase, and Cholinesterases; ACHE & BCHE, Uniprot P22303, P81908, and Q29550
DOI: 10.7270/q2697615
title: BindingDB Entry 50000880: Phenotypic Optimization of Urea-Thiophene Carboxamides To Yield Potent, Well Tolerated, and Orally Active Protective Agents against Aminoglycoside-Induced Hearing Loss.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, and Melanin-concentrating hormone receptor 2/HERG, Uniprot A0A090N8Q0, C1ID52, P08684, P10635, P11712, P33261, Q12809, Q6GRK0, and S5RV20
DOI: 10.7270/q2b27xr3
title: BindingDB Entry 50000879: Synthesis and structure activity relationships of carbamimidoylcarbamate derivatives as novel vascular adhesion protein-1 inhibitors.

description: Small molecule binding data for protein Amine oxidase, copper containing and Vascular adhesion protein 1 (VAP-1), Uniprot O08590 and Q16853
DOI: 10.7270/q22j6f9f
title: BindingDB Entry 50000882: Design, synthesis and biological evaluation of phthalimide-alkylamine derivatives as balanced multifunctional cholinesterase and monoamine oxidase-B inhibitors for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase, Acetylcholinesterase and butyrylcholinesterase (AChE and BChE), Amine oxidase (flavin-containing) A, Amine oxidase [flavin-containing] B, Carboxylic ester hydrolase, Cholinesterase, and Cholinesterases; ACHE & BCHE, Uniprot O42275, P06276, P21397, P22303, P27338, P37136, P81908, Q53YE7, and Q9JKC1
DOI: 10.7270/q2t15634
title: BindingDB Entry 50000884: Discovery of benzo[g]indoles as a novel class of non-covalent Keap1-Nrf2 protein-protein interaction inhibitor.

description: Small molecule binding data for protein Kelch-like ECH-associated protein 1, Uniprot A0A024R7C0 and Q14145
DOI: 10.7270/q2xs5xtr
title: BindingDB Entry 50000883: Design, synthesis and biological evaluation of 2-acetyl-5-O-(amino-alkyl)phenol derivatives as multifunctional agents for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase, Amine oxidase (flavin-containing) A, Amine oxidase [flavin-containing] B, and Cholinesterase, Uniprot O42275, P21397, P27338, P81908, and Q53YE7
DOI: 10.7270/q2jm2d49
title: BindingDB Entry 50000886: Discovery of the First Potent, Selective, and Orally Bioavailable Signal Peptide Peptidase-Like 2a (SPPL2a) Inhibitor Displaying Pronounced Immunomodulatory Effects In Vivo.

description: Small molecule binding data for protein Signal peptide peptidase-like 2A and Signal peptide peptidase-like 2B, Uniprot D3ZNG3, Q8TCT7, Q8TCT8, and Q9JJF9
DOI: 10.7270/q2pc34vm
title: BindingDB Entry 50000885: Preparation of 5'-deoxy-5'-amino-5'-C-methyl adenosine derivatives and their activity against DOT1L.

description: Small molecule binding data for protein Histone-lysine N-methyltransferase, H3 lysine-79 specific, Uniprot Q8TEK3
DOI: 10.7270/q2dv1nc4
title: BindingDB Entry 50000887: Discovery and Preclinical Development of IIIM-290, an Orally Active Potent Cyclin-Dependent Kinase Inhibitor.

description: Small molecule binding data for protein CDK2/Cyclin O, CDK3/E, CDK6/G1/S-specific cyclin D3, CDK9/Cyclin K, Cyclin-Dependent Kinase 1 (CDK1), Cyclin-Dependent Kinase 2 (CDK2), Cyclin-Dependent Kinase 4 (CDK4), Cyclin-Dependent Kinase 5 (CDK5), Cyclin-Dependent Kinase 7 (CDK7), Cyclin-Dependent Kinase 9 (CDK9), Cyclin-dependent kinase 6/G1/S-specific cyclin D1, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, and Melanin-concentrating hormone receptor 2/HERG, Uniprot A0A024R6K1, A0A024R880, A0A024RB77, A0A024RBB6, A0A090N7W4, A0A090N8Q0, A0A0S2Z3F9, C1ID52, O60563, O75909, P05177, P06493, P08684, P10635, P11712, P11802, P20248, P22674, P24385, P24864, P24941, P30281, P33261, P50613, P50750, P51946, Q00526, Q00534, Q00535, Q12809, Q15078, Q6FI00, Q6GRK0, and S5RV20
DOI: 10.7270/q25b04zt
title: BindingDB Entry 50000890: Exploiting the S4-S5 Specificity of Human Neutrophil Proteinase 3 to Improve the Potency of Peptidyl Di(chlorophenyl)-phosphonate Ester Inhibitors: A Kinetic and Molecular Modeling Analysis.

description: Small molecule binding data for protein Leukocyte proteinase 3, Uniprot P24158
DOI: 10.7270/q2930wnq
title: BindingDB Entry 50000889: Tozasertib Analogues as Inhibitors of Necroptotic Cell Death.

description: Small molecule binding data for protein Aurora kinase A/Targeting protein for Xklp2, Aurora kinase B, Receptor-interacting protein 1 (RIPK1), and Receptor-interacting serine/threonine-protein kinase 1, Uniprot A0A024QZU0, O14965, Q13546, Q60855, and Q96GD4
DOI: 10.7270/q21j9d7z
title: BindingDB Entry 50000891: A Structure-Activity Relationship Study of Bitopic N

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2b, and Adenosine receptor A3, Uniprot P0DMS8, P29274, P29275, P30542, and X5DNB4
DOI: 10.7270/q2ws8wqt
title: BindingDB Entry 50000892: ( S)-2-Amino-3-(5-methyl-3-hydroxyisoxazol-4-yl)propanoic Acid (AMPA) and Kainate Receptor Ligands: Further Exploration of Bioisosteric Replacements and Structural and Biological Investigation.

description: Small molecule binding data for protein Glutamate receptor ionotropic, AMPA 2, Glutamate receptor ionotropic, kainate, and Ionotropic glutamate receptor kainate 2/5, Uniprot P19491, P22756, P42260, and P42264
DOI: 10.7270/q2s46vfk
title: BindingDB Entry 50000894: Fragment-Based Drug Discovery of Inhibitors of Phosphopantetheine Adenylyltransferase from Gram-Negative Bacteria.

description: Small molecule binding data for protein Bifunctional coenzyme A synthase, Uniprot Q13057
DOI: 10.7270/q2nc63ps
title: BindingDB Entry 50000895: Structure-based Design of Pyridone-Aminal eFT508 Targeting Dysregulated Translation by Selective Mitogen-activated Protein Kinase Interacting Kinases 1 and 2 (MNK1/2) Inhibition.

description: Small molecule binding data for protein Dual specificity protein kinase CLK1/CLK4, MAP kinase-interacting serine/threonine-protein kinase 1/2, and Serine/threonine-protein kinase 17A, Uniprot Q9BUB5, Q9HAZ1, Q9HBH9, and Q9UEE5
DOI: 10.7270/q2hm5bxm
title: BindingDB Entry 50000896: New Inhibitors of Breast Cancer Resistance Protein (ABCG2) Containing a 2,4-Disubstituted Pyridopyrimidine Scaffold.

description: Small molecule binding data for protein ATP-binding cassette sub-family G member 2, Uniprot A1LUE4 and Q9UNQ0
DOI: 10.7270/q2833vgw
title: BindingDB Entry 50000898: Chemogenomic Profiling of Human and Microbial FK506-Binding Proteins.

description: Small molecule binding data for protein FK506 binding protein 3, FK506 binding protein 4, FK506-binding protein 1B, Outer membrane protein MIP, Peptidyl-prolyl cis-trans isomerase FKBP2, Peptidyl-prolyl cis-trans isomerase FKBP5, Peptidyl-prolyl cis-trans isomerase Mip, and RyR1/FKBP12, Uniprot A0A0F7XLP7, H2E281, P26885, P62942, P68106, Q00688, Q02790, Q13451, Q53XJ5, Q70YI1, and Q9Z7P3
DOI: 10.7270/q2cv4m69
title: BindingDB Entry 50000897: Humanβ-Defensin 1 andβ-Defensin 3 (Mouse Ortholog mBD14) Function as Full Endogenous Agonists at Select Melanocortin Receptors.

description: Small molecule binding data for protein Melanocortin receptor (M4 and M5), Melanocortin receptor 1, Melanocortin receptor 3, Melanocortin receptor 4, Melanocortin receptor 5, and Melanocyte-stimulating hormone receptor, Uniprot A0A0B6VTJ4, P32245, P33032, P33033, P41149, P41968, P56450, Q01726, Q01727, Q1JUL4, and Q544G7
DOI: 10.7270/q24b33s0
title: BindingDB Entry 50000899: Marbostat-100 Defines a New Class of Potent and Selective Antiinflammatory and Antirheumatic Histone Deacetylase 6 Inhibitors.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 10, Histone deacetylase 11, Histone deacetylase 2, Histone deacetylase 3/Nuclear receptor corepressor 2, Histone deacetylase 4, Histone deacetylase 5, Histone deacetylase 6, Histone deacetylase 7, and Histone deacetylase 8, Uniprot A0A024QZ26, O15379, P56524, Q13547, Q6IT96, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UQL6, and Q9Y618
DOI: 10.7270/q20k2c2p
title: BindingDB Entry 50000900: 1-[3-(4-Butylpiperidin-1-yl)propyl]-1,2,3,4-tetrahydroquinolin-2-one (77-LH-28-1) as a Model for the Rational Design of a Novel Class of Brain Penetrant Ligands with High Affinity and Selectivity for Dopamine D

description: Small molecule binding data for protein Adrenergic receptor, Adrenergic receptor alpha, Alpha adrenergic receptor (1a and 1d), Alpha-1A adrenergic receptor, D(2) dopamine receptor, D(3) dopamine receptor, D(4) dopamine receptor, Muscarinic acetylcholine receptor M1 and M3, Muscarinic acetylcholine receptor M1/M5 chimeric protein, Muscarinic acetylcholine receptor M2 and M4, Muscarinic acetylcholine receptor M2 and M5, Sigma-1 receptor, Sodium-dependent dopamine transporter, and Sodium-dependent serotonin transporter, Uniprot A0A024R3C5, A0A024R3W1, A0A024R9I2, A4D1Q0, B0ZBE0, P07550, P08172, P08173, P08588, P08912, P11229, P14416, P20309, P21917, P23977, P25100, P31652, P35348, P35368, P35462, Q53XZ3, Q60492, and X5DQM5
DOI: 10.7270/q2vx0jzv
title: BindingDB Entry 50000901: Discovery of a Potent (4 R,5 S)-4-Fluoro-5-methylproline Sulfonamide Transient Receptor Potential Ankyrin 1 Antagonist and Its Methylene Phosphate Prodrug Guided by Molecular Modeling.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily A member 1, Transient receptor potential cation channel subfamily M member 8 (TRPM8), and Transient receptor potential cation channel subfamily V member 1, Uniprot O75762, Q6RI86, Q7Z2W7, Q8NER1, and W8DTH1