cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q24m95mm
title: BindingDB Entry 50040058: Hit-to-lead investigation of a series of novel combined dopamine D2 and muscarinic M1 receptor ligands with putative antipsychotic and pro-cognitive potential.

description: Small molecule binding data for protein Dopamine receptor D2L/neurotensin receptor NTS1, Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M1/M5 chimeric protein, Muscarinic acetylcholine receptor M2, Muscarinic acetylcholine receptor M2 and M4, and Voltage-gated potassium channel, Uniprot P08172, P08173, P08912, P11229, P14416, P20309, and Q12809
DOI: 10.7270/q28c9x9h
title: BindingDB Entry 50040057: Symmetrical approach of spiro-pyrazolidinediones as acetyl-CoA carboxylase inhibitors.

description: Small molecule binding data for protein Acetyl-CoA carboxylase 1 (ACC1) and Acetyl-CoA carboxylase 2 (ACC2), Uniprot O00763, P11497, and Q13085
DOI: 10.7270/q2959jnp
title: BindingDB Entry 50040468: Acetylcholinesterase inhibitors from the leaves of Macaranga kurzii.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275
DOI: 10.7270/q2d21zpz
title: BindingDB Entry 50040056: Small molecule tertiary amines as agonists of the nuclear hormone receptor Rev-erba.

description: Small molecule binding data for protein Nuclear receptor subfamily 1 group D member 1, Uniprot P20393
DOI: 10.7270/q2dz09d3
title: BindingDB Entry 50040467: Fluorescent Human EP3 Receptor Antagonists.

description: Small molecule binding data for protein Prostaglandin E2 receptor, Prostaglandin E2 receptor EP1 subtype (EP1), Prostaglandin E2 receptor EP2 subtype (EP2), and Prostaglandin E2 receptor EP4 subtype (EP4), Uniprot P34995, P35408, P43115, and P43116
DOI: 10.7270/q2ff3tm8
title: BindingDB Entry 50041730: Large-scale application of high-throughput molecular mechanics with Poisson-Boltzmann surface area for routine physics-based scoring of protein-ligand complexes.

description: Small molecule binding data for protein Protein-tyrosine phosphatase 1B, Serine/threonine-protein kinase Chk1, and Urokinase-type plasminogen activator, Uniprot O14757, P00749, and P18031
DOI: 10.7270/q2g44rfs
title: BindingDB Entry 50040993: Synthesis and In Vitro evaluation of fused ring heterocyle-containing angiotensin II antagonists.

description: Small molecule binding data for protein Angiotensin II type 1a (AT-1a) receptor, Uniprot P34976
DOI: 10.7270/q2jq124t
title: BindingDB Entry 50040466: Aryl Piperazinyl Ureas as Inhibitors of Fatty Acid Amide Hydrolase (FAAH) in Rat, Dog, and Primate.

description: Small molecule binding data for protein Anandamide amidohydrolase, Fatty-acid amide hydrolase 1 (FAAH), and Fatty-acid amide hydrolase 2, Uniprot O00519, P97612, and Q6GMR7
DOI: 10.7270/q2k64k9j
title: BindingDB Entry 50041729: Development of CoMFA and CoMSIA models of affinity and selectivity for indole ligands of cannabinoid CB1 and CB2 receptors.

description: Small molecule binding data for protein Cannabinoid receptor and Cannabinoid receptor 2, Uniprot P20272 and P34972
DOI: 10.7270/q2kw5h6n
title: BindingDB Entry 50040992: A new structural analogue antagonist of peptido-leukotrienes. The discovery of bay x7195

description: Small molecule binding data for protein Cysteinyl leukotriene receptor 1, Uniprot Q2NNR5
DOI: 10.7270/q2pz5b1z
title: BindingDB Entry 50041728: Exploring QSAR and QAAR for inhibitors of cytochrome P450 2A6 and 2A5 enzymes using GFA and G/PLS techniques.

description: Small molecule binding data for protein Cytochrome P450 2A5 and Cytochrome P450 2A6, Uniprot P11509 and P20852
DOI: 10.7270/q2qn67zd
title: BindingDB Entry 50040991: The stoichiometry of binding of flavin mononucleotide (FMN) hydroquinone to Escherichia coli chorismate synthase

description: Small molecule binding data for protein Chorismate synthase, Uniprot P0A2Y6
DOI: 10.7270/q2tm7ccd
title: BindingDB Entry 50041727: GRIND-based 3D-QSAR and CoMFA to investigate topics dominated by hydrophobic interactions: the case of hERG K+ channel blockers.

description: Small molecule binding data for protein Voltage-gated potassium channel, Uniprot Q12809
DOI: 10.7270/q2vd70np
title: BindingDB Entry 50040990: QSAR study of benzoquinolinones as inhibitors of human type 1 5--reductase.

description: Small molecule binding data for protein 5α-Reductase 1 (5α-R1), Uniprot P18405
DOI: 10.7270/q2zc8434
title: BindingDB Entry 50041726: Docking, 3D-QSAR studies and in silico ADME prediction on c-Src tyrosine kinase inhibitors.

description: Small molecule binding data for protein VEGF-receptor 2 and tyrosine-protein kinase SRC, Uniprot P12931
DOI: 10.7270/q2251kdr
title: BindingDB Entry 50041733: Antagonists of the P2X(7) receptor. From lead identification to drug development.

description: Small molecule binding data for protein P2X purinoceptor 7 and P2X purinoceptor 7 (P2X7), Uniprot Q64663 and Q99572
DOI: 10.7270/q22z16pq
title: BindingDB Entry 50040996: Dual metalloprotease inhibitors. I. constrained peptidomimetics of mercaptoacyl dipeptides

description: Small molecule binding data for protein Angiotensin-converting enzyme and Neprilysin, Uniprot P08473 and P12821
DOI: 10.7270/q24f1rv1
title: BindingDB Entry 50040477: 1,2,3,4-tetrahydroquinoline-based selective human neuronal nitric oxide synthase (nNOS) inhibitors: lead optimization studies resulting in the identification of N-(1-(2-(methylamino)ethyl)-1,2,3,4-tetrahydroquinolin-6-yl)thiophene-2-carboximidamide as a preclinical development candidate.

description: Small molecule binding data for protein Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M2, Muscarinic acetylcholine receptor M2 and M4, Nitric oxide synthase, brain, Nitric oxide synthase, inducible, Nitric-oxide synthase (endothelial and brain), and Voltage-gated potassium channel, Uniprot P08172, P08173, P11229, P20309, P29475, P35228, and Q12809
DOI: 10.7270/q25d8sxz
title: BindingDB Entry 50040469: Selective inhibition of the tumor marker aldo-keto reductase family member 1B10 by oleanolic acid.

description: Small molecule binding data for protein Aldo-keto reductase family member 1B10 (AKR1B10), Aldose reductase (AR), DNA polymerase beta, and Phospholipase A2, Uniprot O60218, P04054, P06746, and P15121
DOI: 10.7270/q25x2b5m
title: BindingDB Entry 50041732: Synthesis, in vitro and in vivo evaluation, and radiolabeling of aryl anandamide analogues as candidate radioligands for in vivo imaging of fatty acid amide hydrolase in the brain.

description: Small molecule binding data for protein Anandamide amidohydrolase, Uniprot P97612
DOI: 10.7270/q26m381k
title: BindingDB Entry 50040995: Preparative chiral HPLC separation of all possible stereoisomers of LY191704 and LY266111 and their in vitro inhibition of human types 1 and 2 steroid 5-reductases

description: Small molecule binding data for protein 5α-Reductase 1 (5α-R1) and Steroid 5-alpha-reductase, Uniprot P18405 and P31213
DOI: 10.7270/q29p32wx
title: BindingDB Entry 50041731: Natural product inhibitors of protein-protein interactions mediated by Src-family SH2 domains.

description: Small molecule binding data for protein SRC and VEGF-receptor 2 and tyrosine-protein kinase SRC, Uniprot P06239 and P12931
DOI: 10.7270/q2bc40qf
title: BindingDB Entry 50040994: Substituted lactam biphenyltetrazoles as angiotensin II mediated antihypertensives

description: Small molecule binding data for protein Angiotensin II type 1a (AT-1a) receptor, Uniprot P34976
DOI: 10.7270/q2cz388q
title: BindingDB Entry 50040475: Design and characterization of optimized adenosine A2A/A1 receptor antagonists for the treatment of Parkinson's disease.

description: Small molecule binding data for protein Adenosine receptor A1 and Adenosine receptor A2a, Uniprot P29274 and P30542
DOI: 10.7270/q2gt5p7j
title: BindingDB Entry 50040063: Design, synthesis and biological activity of 6-substituted carbamoyl benzimidazoles as new nonpeptidic angiotensin II AT1 receptor antagonists.

description: Small molecule binding data for protein Angiotensin II receptor and Angiotensin II type 1a (AT-1a) receptor, Uniprot P30556 and P34976
DOI: 10.7270/q2hq411w
title: BindingDB Entry 50040474: The bivalent ligand approach leads to highly potent and selective acylguanidine-type histamine H2 receptor agonists.

description: Small molecule binding data for protein Histamine H2 Receptor, Histamine H2 receptor, Histamine receptor (H3), and Histamine receptor (H4), Uniprot P25021, P47747, Q9H3N8, and Q9Y5N1
DOI: 10.7270/q2mk6dxd
title: BindingDB Entry 50040062: Design, synthesis, biological evaluation and molecular modeling of novel 1,3,4-oxadiazole derivatives based on Vanillic acid as potential immunosuppressive agents.

description: Small molecule binding data for protein PI3-kinase subunit gamma, Uniprot P48736
DOI: 10.7270/q2ng4rrt
title: BindingDB Entry 50040473: Discovery of (S)-6-(3-cyclopentyl-2-(4-(trifluoromethyl)-1H-imidazol-1-yl)propanamido)nicotinic acid as a hepatoselective glucokinase activator clinical candidate for treating type 2 diabetes mellitus.

description: Small molecule binding data for protein Hexokinase type IV, Uniprot P17712 and P35557
DOI: 10.7270/q2nz88w5
title: BindingDB Entry 50041736: Doxazosin-related alpha1-adrenoceptor antagonists with prostate antitumor activity.

description: Small molecule binding data for protein Adrenergic alpha1B, Alpha adrenergic receptor 1A and 1B, Alpha-1A adrenergic receptor, and Alpha-1D adrenergic receptor, Uniprot P15823, P23944, P25100, P35348, P35368, and P43140
DOI: 10.7270/q2pn96sk
title: BindingDB Entry 50040999: Dual metalloprotease inhibitors. III. utilization of bicyclic and monocyclic diazepinone based mercaptoacetyls

description: Small molecule binding data for protein Angiotensin-converting enzyme and Neprilysin, Uniprot P08473 and P12821
DOI: 10.7270/q2rb75n4
title: BindingDB Entry 50040061: Arylstibonic acids are potent and isoform-selective inhibitors of Cdc25a and Cdc25b phosphatases.

description: Small molecule binding data for protein Cdc25C, Dual specificity phosphatase Cdc25B, Dual specificity protein phosphatase (VHR), Dual specificity protein phosphatase 6, Phosphatidylglycerophosphatase and protein-tyrosine phosphatase 1, Phosphatidylinositol 3,4,5-trisphosphate 3-phosphatase and dual-specificity protein phosphatase PTEN, Protein-tyrosine phosphatase 1B, Receptor-type tyrosine-protein phosphatase beta (PTPβ), and phosphatase Cdc25, Uniprot P18031, P23467, P30304, P30305, P30307, P51452, P60484, Q16828, and Q8WUK0
DOI: 10.7270/q2s75hf3
title: BindingDB Entry 50040472: ADME-guided design and synthesis of aryloxanyl pyrazolone derivatives to block mutant superoxide dismutase 1 (SOD1) cytotoxicity and protein aggregation: potential application for the treatment of amyotrophic lateral sclerosis.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P05177, P08684, P10635, P11712, and P33261
DOI: 10.7270/q2td9zhx
title: BindingDB Entry 50040998: Amselamine, a new selective histamine H2-receptor agonist

description: Small molecule binding data for protein Histamine H2 receptor, Uniprot P25102
DOI: 10.7270/q2w37xcg
title: BindingDB Entry 50040060: Discovery of novel hedgehog antagonists from cell-based screening: Isosteric modification of p38 bisamides as potent inhibitors of SMO.

description: Small molecule binding data for protein G-protein- coupled-like receptor Smoothened (Smo) and Mitogen-activated protein kinase 14, Uniprot Q16539 and Q99835
DOI: 10.7270/q2ww7js7
title: BindingDB Entry 50040471: Identification of novela4ß2-nicotinic acetylcholine receptor (nAChR) agonists based on an isoxazole ether scaffold that demonstrate antidepressant-like activity.

description: Small molecule binding data for protein Neuronal acetylcholine receptor, Uniprot Q05941
DOI: 10.7270/q2xd12xf
title: BindingDB Entry 50041734: Synthesis of novel 1-alkyl-8-substituted-3-(3-methoxypropyl) xanthines as putative A(2B) receptor antagonists.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2b, and Adenosine receptor A3, Uniprot P0DMS8, P25099, P29274, and P29275
DOI: 10.7270/q2z60q76
title: BindingDB Entry 50040997: Dual metalloprotease inhibitors. II. Effect of substitution and stereochemistry on benzazepinone based mercaptoacetyls

description: Small molecule binding data for protein Angiotensin-converting enzyme and Neprilysin, Uniprot P08473 and P12821
DOI: 10.7270/q20p115j
title: BindingDB Entry 50040478: Dynamic modeling of human 5-lipoxygenase-inhibitor interactions helps to discover novel inhibitors.

description: Small molecule binding data for protein 5-lipoxygenase/FLAP, Arachidonate 5-lipoxygenase, and Prostaglandin E synthase, Uniprot O14684, P09917, and P12527
DOI: 10.7270/q21z45m7
title: BindingDB Entry 50041004: Design, synthesis and evaluation of dual domain FKBP ligands

description: Small molecule binding data for protein Mammalian target of Rapamycin (mTORC1), Uniprot P62942
DOI: 10.7270/q23n24gs
title: BindingDB Entry 50040066: Potent and Selective Inhibitors of CK2 Kinase Identified through Structure-Guided Hybridization.

description: Small molecule binding data for protein Casein Kinase II, Cyclin-dependent kinase 2, Cytochrome P450 1A, Glycogen synthase kinase-3, Homeodomain-interacting protein kinase 2 (HIPK2), and Voltage-gated potassium channel, Uniprot P05177, P24941, P49841, P68400, Q12809, and Q9H2X6
DOI: 10.7270/q25q4x8p
title: BindingDB Entry 50041003: A non-steroidal diene acid inhibitor of human type 2 stereoid 5-reductase

description: Small molecule binding data for protein 5α-Reductase 1 (5α-R1) and Steroid 5-alpha-reductase, Uniprot P18405 and P31213
DOI: 10.7270/q27d2w7k
title: BindingDB Entry 50040065: Avicholic Acid: A Lead Compound from Birds on the Route to Potent TGR5 Modulators.

description: Small molecule binding data for protein Bile acid receptor FXR and G-protein coupled bile acid receptor 1, Uniprot Q8TDU6 and Q96RI1
DOI: 10.7270/q2862hj9
title: BindingDB Entry 50040476: Identification and preliminary characterization of a potent, safe, and orally efficacious inhibitor of acyl-CoA:diacylglycerol acyltransferase 1.

description: Small molecule binding data for protein Diacylglycerol O-acyltransferase 1, Diacylglycerol O-acyltransferase 1 (DGAT1), Diacylglycerol O-acyltransferase 2, and Voltage-gated potassium channel, Uniprot O75907, Q12809, Q96PD7, and Q9Z2A7
DOI: 10.7270/q28p61rj
title: BindingDB Entry 50041739: Arginine vasopressin and its analogues--the influence of position 2 modification with 3,3-diphenylalanine enantiomers. Highly potent V2 agonists.

description: Small molecule binding data for protein AVPR1A and Oxytocin receptor, Uniprot P30560 and P70536
DOI: 10.7270/q29c6zm4
title: BindingDB Entry 50041002: Pyridine and piperidine derivatives as inhibitors of dihydrodipicolinic acid synthase, a key enzyme in the diaminopimelate pathway to l-lysine

description: Small molecule binding data for protein Dihydrodipicolinate synthase
DOI: 10.7270/q2c53mxf
title: BindingDB Entry 50040064: Synthesis and structure-activity relationship studies of 1,3-disubstituted 2-propanols as BACE-1 inhibitors.

description: Small molecule binding data for protein Beta-secretase 1 and Cathepsin D, Uniprot P07339 and P56817
DOI: 10.7270/q2df6sff
title: BindingDB Entry 50041738: Synthesis and preliminary screening of novel indole-3-methanamines as 5-HT4 receptor ligands.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 4 (5-HT4), Uniprot Q13639
DOI: 10.7270/q2j67j55
title: BindingDB Entry 50041737: Dopamine D(3) receptor antagonists: The quest for a potentially selective PET ligand. Part two: Lead optimization.

description: Small molecule binding data for protein Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, and Voltage-gated potassium channel, Uniprot P14416, P19020, P35462, and Q12809
DOI: 10.7270/q2jw8g1t
title: BindingDB Entry 50041000: Argatroban analogs: Synthesis, thrombin inhibitory activity and cell permeability of aminoheterocyclic guanidine surrogates

description: Small molecule binding data for protein Prothrombin, Uniprot P00734
DOI: 10.7270/q2mg7qmf
title: BindingDB Entry 50040481: Discovery and characterization of an inhibitor of glucosylceramide synthase.

description: Small molecule binding data for protein Ceramide glucosyltransferase and Cytochrome P450 3A, Uniprot P08684 and Q16739
DOI: 10.7270/q2r78gb5
title: BindingDB Entry 50040480: Sesquiterpene lactones from Tithonia diversifolia act as peroxisome proliferator-activated receptor agonists.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Uniprot P37231
DOI: 10.7270/q2sq91mw
title: BindingDB Entry 50041735: Clobenpropit analogs as dual activity ligands for the histamine H3 and H4 receptors: synthesis, pharmacological evaluation, and cross-target QSAR studies.

description: Small molecule binding data for protein Histamine receptor (H3) and Histamine receptor (H4), Uniprot Q9H3N8 and Q9Y5N1
DOI: 10.7270/q2w0971f
title: BindingDB Entry 50040479: Discovery of highly potent and selective pan-Aurora kinase inhibitors with enhanced in vivo antitumor therapeutic index.

description: Small molecule binding data for protein Aurora kinase B/Inner centromere protein, Serine/threonine-protein kinase Aurora, and Serine/threonine-protein kinase Aurora-C, Uniprot O14965, Q96GD4, and Q9UQB9
DOI: 10.7270/q2154j9t
title: BindingDB Entry 50041741: Dopamine D3 receptor antagonists: the quest for a potentially selective PET ligand. Part one: lead identification.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, Dopamine receptors; D2 & D4, and Voltage-gated potassium channel, Uniprot P14416, P21917, P28223, P35462, and Q12809
DOI: 10.7270/q23f4qsj
title: BindingDB Entry 50040485: Structure-based design of a novel series of potent, selective inhibitors of the class I phosphatidylinositol 3-kinases.

description: Small molecule binding data for protein DNA-dependent protein kinase, PI3-kinase subunit alpha, PI3-kinase subunit beta, PI3-kinase subunit delta, PI3-kinase subunit gamma, PI4KA/PI4KAP2, Phosphatidylinositol 3-kinase catalytic subunit type 3, Phosphatidylinositol 4-kinase beta (PIK4KB), Phosphatidylinositol 4-phosphate 3-kinase C2 alpha (PIK3C2A), Phosphatidylinositol-4-phosphate 3-kinase C2 domain-containing beta polypeptide, and Serine/threonine-protein kinase mTOR, Uniprot O00329, O00443, O00750, P42336, P42338, P42345, P48736, P78527, Q8NEB9, and Q9UBF8
DOI: 10.7270/q24x5917
title: BindingDB Entry 50041740: Synthesis of quinolinyl and isoquinolinyl phenyl ketones as novel agonists for the cannabinoid CB2 receptor.

description: Small molecule binding data for protein Cannabinoid receptor 2, Uniprot P34972
DOI: 10.7270/q2765gfc
title: BindingDB Entry 50040484: Classification of inhibitors of hepatic organic anion transporting polypeptides (OATPs): influence of protein expression on drug-drug interactions.

description: Small molecule binding data for protein ATP-binding cassette sub-family G member 2, Multidrug resistance-associated protein 2 (MRP2), P-glycoprotein 1, Solute carrier organic anion transporter family member 1B1 (OATP1B1), Solute carrier organic anion transporter family member 1B3 (OATP1B3), and Solute carrier organic anion transporter family member 2B1, Uniprot O94956, P08183, Q92887, Q9NPD5, Q9UNQ0, and Q9Y6L6
DOI: 10.7270/q28g8mw2
title: BindingDB Entry 50041010: Design, synthesis and biological activity of some 4-DAMP- related compounds

description: Small molecule binding data for protein Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, Muscarinic receptor M1 and M2, and Muscarinic receptor M2 and M3, Uniprot P08173, P08482, P08483, and P10980
DOI: 10.7270/q2bz674b
title: BindingDB Entry 50040483: Cytotoxic effects of combination of oxidosqualene cyclase inhibitors with atorvastatin in human cancer cells.

description: Small molecule binding data for protein Lanosterol synthase, Uniprot P48449
DOI: 10.7270/q2gq6zv8
title: BindingDB Entry 50040482: Potent aminocyclitol glucocerebrosidase inhibitors are subnanomolar pharmacological chaperones for treating gaucher disease.

description: Small molecule binding data for protein Glucocerebrosidase (Acid beta-Glucosidase), Uniprot P04062
DOI: 10.7270/q2h70h2s
title: BindingDB Entry 50041745: Evaluation of hydrogen bonds of ecdysteroids in the ligand-receptor interactions using a protein modeling system.

description: Small molecule binding data for protein Ecdysone receptor, Uniprot P34021
DOI: 10.7270/q2hx1dv4
title: BindingDB Entry 50041008: Novel prostanoid thromboxane A2 antagonists

description: Small molecule binding data for protein Prostanoid TP receptor, Uniprot P21731
DOI: 10.7270/q2kk9cvx
title: BindingDB Entry 50040070: Fungal bis-Naphthopyrones as Inhibitors of Botulinum Neurotoxin Serotype A.

description: Small molecule binding data for protein botulinum neurotoxin type A, Uniprot A5HZZ9
DOI: 10.7270/q2n017s3
title: BindingDB Entry 50041744: Design of selective Cathepsin inhibitors.

description: Small molecule binding data for protein Cathepsin (B and K), Cathepsin K, Cathepsin L1, Cathepsin S, and Cathepsin V, Uniprot O60911, P07711, P07858, P25774, and P43235
DOI: 10.7270/q2qc04jr
title: BindingDB Entry 50040069: Synthesis and biochemical evaluation of thiochromanone thiosemicarbazone analogues as inhibitors of cathepsin L.

description: Small molecule binding data for protein Cathepsin (B and K) and Cathepsin L1, Uniprot P07711 and P07858
DOI: 10.7270/q2rr20hh
title: BindingDB Entry 50041743: Highly tractable, sub-nanomolar non-steroidal glucocorticoid receptor agonists.

description: Small molecule binding data for protein Glucocorticoid receptor, Uniprot P04150
DOI: 10.7270/q2v125xn
title: BindingDB Entry 50040487: Discovery of novel PI3-kinased specific inhibitors for the treatment of rheumatoid arthritis: taming CYP3A4 time-dependent inhibition.

description: Small molecule binding data for protein Cytochrome P450 3A and PI3-kinase subunit delta, Uniprot O00329 and P08684
DOI: 10.7270/q2v40w83
title: BindingDB Entry 50040068: The Rhodadyns, a New Class of Small Molecule Inhibitors of Dynamin GTPase Activity.

description: Small molecule binding data for protein Dynamin-1, Uniprot Q05193
DOI: 10.7270/q2wh2r7v
title: BindingDB Entry 50041742: Novel, achiral aminoheterocycles as selective monoamine reuptake inhibitors.

description: Small molecule binding data for protein Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, and Sodium-dependent noradrenaline transporter, Uniprot P23975, P31645, and Q01959
DOI: 10.7270/q2x63p48
title: BindingDB Entry 50041005: Synthesis and antiviral activity of a novel class of HIV-1 protease inhibitors containing a heterocyclic P1-P2 amide bond isostere

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q2zs2xm7
title: BindingDB Entry 50040486: Substrates for efficient fluorometric screening employing the NAD-dependent sirtuin 5 lysine deacylase (KDAC) enzyme.

description: Small molecule binding data for protein NAD-dependent protein deacetylase sirtuin-5 (SIRT5), Uniprot Q9NXA8
DOI: 10.7270/q2zw1n0h
title: BindingDB Entry 50040067: Dual-Specificity Phosphatase CDC25A/B Inhibitor Identified from a Focused Library with Nonelectrophilic Core Structure.

description: Small molecule binding data for protein Cdc25C, Dual Specificity Protein Phosphatase 1, Dual specificity phosphatase Cdc25B, Dual specificity protein phosphatase (VHR), Dual specificity protein phosphatase 6, Protein-tyrosine phosphatase 1B, and phosphatase Cdc25, Uniprot P18031, P28562, P30304, P30305, P30307, P51452, and Q16828
DOI: 10.7270/q20866j9
title: BindingDB Entry 50041749: Novel and potent small-molecule urotensin II receptor agonists.

description: Small molecule binding data for protein Urotensin-2, Uniprot O95399