cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2542nhw
title: BindingDB Entry 50028799: Structure-activity relationships of heteroaromatic esters as human rhinovirus 3C protease inhibitors.

description: Small molecule binding data for protein Genome polyprotein, Uniprot Q82122
DOI: 10.7270/q25b02jm
title: BindingDB Entry 50030860: Synthesis and biological evaluation of p38alpha kinase-targeting dialkynylimidazoles.

description: Small molecule binding data for protein MAP kinase p38, Mitogen-activated protein kinase 14, and Mitogen-activated protein kinase kinase kinase kinase 4, Uniprot O95819, Q15759, and Q16539
DOI: 10.7270/q25b02nz
title: BindingDB Entry 50031805: Molecular docking studies of phlorotannins from Eisenia bicyclis with BACE1 inhibitory activity.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q27944p1
title: BindingDB Entry 50029868: TBA

description: Small molecule binding data for protein P-selectin/P-selectin glycoprotein ligand 1 and Selectin E, Uniprot P16109 and P16581
DOI: 10.7270/q2862gfj
title: BindingDB Entry 50029858: TBA

description: Small molecule binding data for protein Mammalian target of Rapamycin (mTORC1), Uniprot P62942
DOI: 10.7270/q2930t7h
title: BindingDB Entry 50030858: Identification of iminooxothiazolidines as secreted frizzled related protein-1 inhibitors.

description: Small molecule binding data for protein Secreted frizzled-related protein 1, Uniprot Q8N474
DOI: 10.7270/q2930t9d
title: BindingDB Entry 50031804: Discovery of N-phenyl-4-(thiazol-5-yl)pyrimidin-2-amine aurora kinase inhibitors.

description: Small molecule binding data for protein AKT/p21CIP1, Aurora kinase B/Inner centromere protein, CDK2/CycE, Cyclin-Dependent Kinase 1 (CDK1), Cyclin-Dependent Kinase 7 (CDK7), Cyclin-Dependent Kinase 9 (CDK9), Cyclin-dependent kinase 1, Cyclin-dependent kinase 2, Cyclin-dependent kinase 4, Cyclin-dependent kinase 9, Glycogen synthase kinase-3, MAP kinase ERK2, Mitogen-activated protein kinase 14, Ribosomal protein S6 kinase (P70S6K), SRC, Serine/threonine-protein kinase Aurora, Serine/threonine-protein kinase PLK1, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase receptor FLT3, VEGF-receptor 2 and tyrosine-protein kinase SRC, and Vascular endothelial growth factor receptor 2, Uniprot O14965, O60563, P00519, P06239, P06493, P11802, P12931, P14635, P23443, P24864, P24941, P28482, P31749, P35968, P36888, P49840, P49841, P50613, P50750, P51946, P53350, Q16539, and Q96GD4
DOI: 10.7270/q2bz661k
title: BindingDB Entry 50029866: TBA

description: Small molecule binding data for protein Steroid 5-alpha-reductase, Uniprot P18405 and P31213
DOI: 10.7270/q2cn73t7
title: BindingDB Entry 50028812: 1-amino-4-benzylphthalazines as orally bioavailable smoothened antagonists with antitumor activity.

description: Small molecule binding data for protein G-protein- coupled-like receptor Smoothened (Smo) and Smoothened homolog, Uniprot P56726 and Q99835
DOI: 10.7270/q2cv4ht4
title: BindingDB Entry 50030868: Discovery of pyrazol-3-ylamino pyrazines as novel JAK2 inhibitors.

description: Small molecule binding data for protein Aurora kinase B/Inner centromere protein, Cyclin-dependent kinase 2, JAK3/JAK1, Neurotrophic tyrosine kinase receptor, Transcription factor STAT5b (STAT5b), and Tyrosine-protein kinase JAK2, Uniprot O60674, P04629, P24941, P51692, P52333, and Q96GD4
DOI: 10.7270/q2cv4hxg
title: BindingDB Entry 50031811: Discovery of highly selective inhibitors of human fatty acid binding protein 4 (FABP4) by virtual screening.

description: Small molecule binding data for protein Fatty acid binding protein muscle and Fatty acid-binding protein 4 (FABP4), Uniprot P05413 and P15090
DOI: 10.7270/q2dn450g
title: BindingDB Entry 50028792: Discovery of tetrasubstituted imidazolines as potent and selective neuropeptide Y Y5 receptor antagonists: reduced human ether-a-go-go related gene potassium channel binding affinity and potent antiobesity effect.

description: Small molecule binding data for protein Neuropeptide Y receptor type 1, Neuropeptide Y receptor type 2, Neuropeptide Y receptor type 5 ( NPY Y5), PPYR1, and Voltage-gated potassium channel, Uniprot P25929, P49146, P50391, Q12809, and Q15761
DOI: 10.7270/q2dv1jzh
title: BindingDB Entry 50030857: Discovery and optimization of potent and selective triazolopyridazine series of c-Met inhibitors.

description: Small molecule binding data for protein Cytochrome P450 3A, Hepatocyte growth factor receptor, and Voltage-gated potassium channel, Uniprot P08581, P08684, and Q12809
DOI: 10.7270/q2dv1k1t
title: BindingDB Entry 50031803: Rational design of a topical androgen receptor antagonist for the suppression of sebum production with properties suitable for follicular delivery.

description: Small molecule binding data for protein Androgen Receptor, Estradiol receptor alpha (ERα), Glucocorticoid receptor, and Progesterone receptor, Uniprot P03372, P04150, P06401, and P10275
DOI: 10.7270/q2gq6xq2
title: BindingDB Entry 50029865: TBA

description: Small molecule binding data for protein Dihydrofolate reductase and Thymidylate synthase, Uniprot P00374 and P04818
DOI: 10.7270/q2hd7vk1
title: BindingDB Entry 50028811: Synthesis and evaluation of sphingosine analogues as inhibitors of sphingosine kinases.

description: Small molecule binding data for protein Sphingosine kinase 1 (SPHK1) and Sphingosine kinase types 2 (SphK2), Uniprot Q9NRA0 and Q9NYA1
DOI: 10.7270/q2hm58jv
title: BindingDB Entry 50030867: (1-(4-(Naphthalen-2-yl)pyrimidin-2-yl)piperidin-4-yl)methanamine: a wingless beta-catenin agonist that increases bone formation rate.

description: Small molecule binding data for protein Dickkopf-related protein 1 and Glycogen synthase kinase-3, Uniprot O94907 and P49841
DOI: 10.7270/q2hm58mr
title: BindingDB Entry 50031810: Regiospecific and conformationally restrained analogs of melphalan and DL-2-NAM-7 and their affinities for the large neutral amino acid transporter (system LAT1) of the blood-brain barrier.

description: Small molecule binding data for protein L-type amino acid transporter 1, Uniprot Q63016
DOI: 10.7270/q2mg7pg7
title: BindingDB Entry 50029864: TBA

description: Small molecule binding data for protein Squalene synthetase, Uniprot P37268
DOI: 10.7270/q2n58m89
title: BindingDB Entry 50028810: Identification of anxiolytic/nonsedative agents among indol-3-ylglyoxylamides acting as functionally selective agonists at the gamma-aminobutyric acid-A (GABAA) alpha2 benzodiazepine receptor.

description: Small molecule binding data for protein GABA A receptor alpha-5/beta-3/gamma-2, GABA(A) receptor subunit alpha-2, and Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1), Uniprot P19969, P23576, and P62813
DOI: 10.7270/q2nc6191
title: BindingDB Entry 50030865: Pentacycle derivatives as cannabinoid CB1 receptor ligands.

description: Small molecule binding data for protein Cannabinoid receptor and Cannabinoid receptor 2, Uniprot P20272 and P34972
DOI: 10.7270/q2nc61cx
title: BindingDB Entry 50031809: 1,4-dihydropyrazolo[4,3-d]imidazole phenyl derivatives: a novel type II Raf kinase inhibitors.

description: Small molecule binding data for protein C-RAF, Uniprot P04049
DOI: 10.7270/q2r78f6z
title: BindingDB Entry 50029863: TBA

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q2rx9bzv
title: BindingDB Entry 50028808: Orally active C-6 heteroaryl- and heterocyclyl-substituted imidazo[1,2-a]pyridine acid pump antagonists (APAs).

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/q2s46s1c
title: BindingDB Entry 50030863: Evaluation of substituted 6-arylquinazolin-4-amines as potent and selective inhibitors of cdc2-like kinases (Clk).

description: Small molecule binding data for protein CDC2-like kinase 3 (CLK3), Casein kinase I, Casein kinase I delta/epsilon, Casein kinase I isoform delta, Casein kinase I isoform gamma-3, Dual specificity protein kinase CLK2, Dual specificity protein kinase CLK4, Dual specificty protein kinase CLK1, Dual-specificity tyrosine-phosphorylation regulated kinase 1A, Dual-specificity tyrosine-regulated kinases 1B, Epidermal growth factor receptor, SPS1/STE20-related protein kinase YSK4, and Serine/threonine-protein kinase PIM, Uniprot P00533, P11309, P48730, P49674, P49759, P49760, P49761, P78368, Q13627, Q56UN5, Q86V86, Q9HAZ1, Q9Y463, and Q9Y6M4
DOI: 10.7270/q2s46s4q
title: BindingDB Entry 50031808: Novel alpha-7 nicotinic acetylcholine receptor agonists containing a urea moiety: identification and characterization of the potent, selective, and orally efficacious agonist 1-[6-(4-fluorophenyl)pyridin-3-yl]-3-(4-piperidin-1-ylbutyl) urea (SEN34625/WYE-103914).

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 4 (5-HT4), Alpha-2A adrenergic receptor, Alpha-2B adrenergic receptor, Neuronal acetylcholine receptor, Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Serotonin 3 (5-HT3) receptor, and Voltage-gated potassium channel, Uniprot P08913, P17787, P18089, P43681, P46098, Q05941, Q12809, and Q13639
DOI: 10.7270/q2v124sf
title: BindingDB Entry 50029872: TBA

description: Small molecule binding data for protein Carbonic anhydrases; II & IX, Uniprot P00918
DOI: 10.7270/q2w095x8
title: BindingDB Entry 50029861: TBA

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease and Human rhinovirus A protease
DOI: 10.7270/q2wm1dbq
title: BindingDB Entry 50028805: Carbamates as potent calcitonin gene-related peptide antagonists with improved solution stability.

description: Small molecule binding data for protein Calcitonin gene-related peptide type 1 receptor, Uniprot Q16602
DOI: 10.7270/q2ws8tb2
title: BindingDB Entry 50030862: The design of potent and selective inhibitors of DPP-4: optimization of ADME properties by amide replacements.

description: Small molecule binding data for protein Dipeptidyl peptidase 2 (DPP II), Dipeptidyl peptidase 4 (DPP4), Dipeptidyl peptidase IX, Dipeptidyl peptidase VIII, and Endopeptidase prolyl oligopeptidase (PREP), Uniprot P27487, P48147, Q6V1X1, Q86TI2, and Q9UHL4
DOI: 10.7270/q2zs2whg
title: BindingDB Entry 50029871: TBA

description: Small molecule binding data for protein Alpha-L-fucosidase I, Alpha-glucosidase A (α-Gal A), Alpha-mannosidase, Beta-galactosidase, Glucocerebrosidase (Acid beta-Glucosidase), and Lysosomal alpha-glucosidase, Uniprot P04062, P04066, P06280, P10253, and P16278
DOI: 10.7270/q20c4vp7
title: BindingDB Entry 50028827: Discovery of spirocyclic secondary amine-derived tertiary ureas as highly potent, selective and bioavailable soluble epoxide hydrolase inhibitors.

description: Small molecule binding data for protein Calcium channel (Type L), Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Epoxide hydratase, Epoxide hydrolase 1, Epoxide hydrolase 2, and Voltage-gated sodium channel subunit Nav1.5, Uniprot P07099, P08684, P10635, P11712, P34913, P80299, Q13936, and Q14524
DOI: 10.7270/q20k28ph
title: BindingDB Entry 50030873: 1-(2-Aminoethyl)-3-(arylsulfonyl)-1H-pyrrolopyridines are 5-HT(6) receptor ligands.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6), Uniprot P50406
DOI: 10.7270/q20p106k
title: BindingDB Entry 50031816: Discovery of 4-[1-[([1-[4-(trifluoromethyl)benzyl]-1H-indol-7-yl]carbonyl)amino]cyclopropyl]benzoic acid (MF-766), a highly potent and selective EP4 antagonist for treating inflammatory pain.

description: Small molecule binding data for protein G protein-coupled receptor 44, Prostaglandin E2 receptor, Prostaglandin E2 receptor EP1 subtype (EP1), Prostaglandin E2 receptor EP2 subtype (EP2), Prostaglandin E2 receptor EP4 subtype (EP4), Prostanoid DP receptor, Prostanoid FP receptor, Prostanoid IP receptor, and Prostanoid TP receptor, Uniprot P21731, P34995, P35408, P43088, P43115, P43116, P43119, Q13258, and Q9Y5Y4
DOI: 10.7270/q22j6bvc
title: BindingDB Entry 50029880: TBA

description: Small molecule binding data for protein Acetylcholinesterase, Amine oxidase [flavin-containing] A, and Amine oxidase [flavin-containing] B, Uniprot P21397, P22303, and P27338
DOI: 10.7270/q2348k8k
title: BindingDB Entry 50028844: Identification of peptide substrate and small molecule inhibitors of testis-specific serine/threonine kinase1 (TSSK1) by the developed assays.

description: Small molecule binding data for protein Testis-specific serine/threonine-protein kinase 1, Uniprot Q9BXA7
DOI: 10.7270/q2445mch
title: BindingDB Entry 50028826: Discovery of novel motilin antagonists: Conversion of tetrapeptide leads to orally available peptidomimetics.

description: Small molecule binding data for protein Motilin receptor
DOI: 10.7270/q24b31d7
title: BindingDB Entry 50030872: Biaryl ethers as novel non-nucleoside reverse transcriptase inhibitors with improved potency against key mutant viruses.

description: Small molecule binding data for protein Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P08684, P10635, and P11712
DOI: 10.7270/q24f1qw2
title: BindingDB Entry 50031814: Synthesis and evaluation of azabicyclo[3.2.1]octane derivatives as potent mixed vasopressin antagonists.

description: Small molecule binding data for protein Vasopressin V1a receptor (V1a) and Vasopressin V2 receptor (V2), Uniprot P30518 and P37288
DOI: 10.7270/q26973k3
title: BindingDB Entry 50029879: TBA

description: Small molecule binding data for protein Endothelin-converting enzyme 1 (ECE1), Uniprot P42892
DOI: 10.7270/q2765fgd
title: BindingDB Entry 50031823: New aminopropandiol derivatives as orally available and short-acting calcium-sensing receptor antagonists.

description: Small molecule binding data for protein Calcium-sensing receptor (CaSR) and Cytochrome P450 2D6 (2D6), Uniprot P10635 and P41180
DOI: 10.7270/q27w6c3x
title: BindingDB Entry 50028825: Novel sulfone-containing di- and trisubstituted cyclohexanes as potent CC chemokine receptor 2 (CCR2) antagonists.

description: Small molecule binding data for protein C-C chemokine receptor type 2, Uniprot O95950 and P41597
DOI: 10.7270/q2833s34
title: BindingDB Entry 50030870: Novel pyrazolopyrimidines as highly potent B-Raf inhibitors.

description: Small molecule binding data for protein RAF serine/threonine protein kinase, Uniprot P15056
DOI: 10.7270/q2833s7x
title: BindingDB Entry 50031813: Synthesis and biological evaluation of tricyclic anilinopyrimidines as IKKbeta inhibitors.

description: Small molecule binding data for protein Inhibitor of NF-kappa-B kinase (IKK), Uniprot O14920
DOI: 10.7270/q2b27v80
title: BindingDB Entry 50029878: TBA

description: Small molecule binding data for protein Neurokinin 2 receptor, Uniprot P21452
DOI: 10.7270/q2bp02pd
title: BindingDB Entry 50028839: Structural assessment and biological evaluation of two N3S bombesin derivatives.

description: Small molecule binding data for protein GRPR, Uniprot P30550 and X5D7H2
DOI: 10.7270/q2bv7gpr
title: BindingDB Entry 50030880: Incorporation of water-solubilizing groups in pyrazolopyrimidine mTOR inhibitors: discovery of highly potent and selective analogs with improved human microsomal stability.

description: Small molecule binding data for protein PI3-kinase subunit alpha, PI3-kinase subunit beta, PI3-kinase subunit delta, PI3-kinase subunit gamma, and Serine/threonine-protein kinase mTOR, Uniprot O00329, P42336, P42338, P42345, and P48736
DOI: 10.7270/q2bv7gtj
title: BindingDB Entry 50031822: Rapid synthesis of an array of trisubstituted urea-based soluble epoxide hydrolase inhibitors facilitated by a novel solid-phase method.

description: Small molecule binding data for protein Cytochrome P450 2C9, Cytochrome P450 2J2, Epoxide hydratase, and Epoxide hydrolase 2, Uniprot P11712, P34913, P51589, and P80299
DOI: 10.7270/q2fq9wm4
title: BindingDB Entry 50029876: TBA

description: Small molecule binding data for protein Cathepsin D and Human immunodeficiency virus type 1 protease, Uniprot P07339
DOI: 10.7270/q2gf0tdr
title: BindingDB Entry 50028836: Discovery of (2R)-2-(3-{3-[(4-Methoxyphenyl)carbonyl]-2-methyl-6-(trifluoromethoxy)-1H-indol-1-yl}phenoxy)butanoic acid (MK-0533): a novel selective peroxisome proliferator-activated receptor gamma modulator for the treatment of type 2 diabetes mellitus with a reduced potential to increase plasma a

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Peroxisome proliferator-activated receptor alpha, and Peroxisome proliferator-activated receptor alpha (PPAR alpha), Uniprot P23204, P37231, Q07869, and Q95N78
DOI: 10.7270/q2gm87c1
title: BindingDB Entry 50030879: N3-arylmalonamides: a new series of thieno[3,2-b]pyridine based inhibitors of c-Met and VEGFR2 tyrosine kinases.

description: Small molecule binding data for protein Hepatocyte growth factor receptor and Vascular endothelial growth factor receptor 2, Uniprot P08581 and P35968
DOI: 10.7270/q2gm87gc
title: BindingDB Entry 50031821: Design, synthesis and evaluation of 2,4-disubstituted pyrimidines as cholinesterase inhibitors.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BuChE), Uniprot O42275 and P81908
DOI: 10.7270/q2kh0n9z
title: BindingDB Entry 50029875: TBA

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q2m61k5x
title: BindingDB Entry 50028835: Antagonists of the calcium receptor I. Amino alcohol-based parathyroid hormone secretagogues.

description: Small molecule binding data for protein Beta-1 adrenergic receptor, Beta-2 adrenergic receptor and beta-3 adrenergic receptor, Beta-3 adrenergic receptor, Calcium-sensing receptor (CaSR), Cytochrome P450 2D6 (2D6), Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, Sodium-dependent noradrenaline transporter, and Voltage-gated potassium channel, Uniprot P07550, P08588, P10635, P13945, P23975, P31645, P41180, Q01959, and Q12809
DOI: 10.7270/q2mc903r
title: BindingDB Entry 50030878: Exploration of O-spiroketal C-arylglucosides as novel and selective renal sodium-dependent glucose co-transporter 2 (SGLT2) inhibitors.

description: Small molecule binding data for protein Sodium/glucose cotransporter 1 (SGLT1) and Sodium/glucose cotransporter 2 (SGLT2), Uniprot P13866 and P31639
DOI: 10.7270/q2mc905n
title: BindingDB Entry 50031820: Syntheses and structure-activity relationship (SAR) studies of 2,5-diazabicyclo[2.2.1]heptanes as novel alpha7 neuronal nicotinic receptor (NNR) ligands.

description: Small molecule binding data for protein Neuronal acetylcholine receptor, Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Neuronal acetylcholine receptor protein alpha-7 subunit, and Voltage-gated potassium channel, Uniprot P09483, P12390, P36544, Q05941, and Q12809
DOI: 10.7270/q2p84bvf
title: BindingDB Entry 50029883: TBA

description: Small molecule binding data for protein Complement C1r subcomponent, Complement C1s, Kallikrein-1 (KLK1), Plasminogen, Prothrombin, and Trypsin-1, Uniprot P00734, P00736, P00747, P06870, P07477, and P09871
DOI: 10.7270/q2q81d24
title: BindingDB Entry 50029873: TBA

description: Small molecule binding data for protein Selectin E, Uniprot Q00690
DOI: 10.7270/q2qz29wx
title: BindingDB Entry 50028832: Inhibition of sphingosine-1-phosphate lyase for the treatment of autoimmune disorders.

description: Small molecule binding data for protein Sphingosine-1-phosphate lyase 1, Uniprot Q8R0X7
DOI: 10.7270/q2r49qv4
title: BindingDB Entry 50030877: Structure-activity relationships of 6-(2,6-dichlorophenyl)-8-methyl-2-(phenylamino)pyrido[2,3-d]pyrimidin-7-ones: toward selective Abl inhibitors.

description: Small molecule binding data for protein Mitogen-activated protein kinase 14, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase Kit (Kit), and VEGF-receptor 2 and tyrosine-protein kinase SRC, Uniprot P00519, P10721, P12931, and Q16539
DOI: 10.7270/q2r49qx1
title: BindingDB Entry 50031818: Mapping the ATP-binding domain of DNA-dependent protein kinase (DNA-PK) with coumarin- and isocoumarin-derived inhibitors.

description: Small molecule binding data for protein DNA-dependent protein kinase, Uniprot P78527
DOI: 10.7270/q2t153mm
title: BindingDB Entry 50029882: TBA

description: Small molecule binding data for protein DNA topoisomerase I (Topo I), Uniprot P11387
DOI: 10.7270/q2vq32k6
title: BindingDB Entry 50028831: Site-activated multifunctional chelator with acetylcholinesterase and neuroprotective-neurorestorative moieties for Alzheimer's therapy.

description: Small molecule binding data for protein Acetylcholinesterase and Acetylcholinesterase and butyrylcholinesterase (AChE and BChE), Uniprot P37136
DOI: 10.7270/q2vx0gk3
title: BindingDB Entry 50030875: Multidentate small-molecule inhibitors of vaccinia H1-related (VHR) phosphatase decrease proliferation of cervix cancer cells.

description: Small molecule binding data for protein Dual Specificity Protein Phosphatase 1, Dual specificity protein phosphatase (VHR), Hematopoietic protein-tyrosine phosphatase (HEPTP), Protein-tyrosine phosphatase 1B, Tyrosine-Protein Phosphatase (CD45), and phosphatase Cdc25, Uniprot P08575, P18031, P28562, P30304, P35236, and P51452
DOI: 10.7270/q2vx0gpf
title: BindingDB Entry 50031817: Discovery of 6-chloro-2-trifluoromethyl-7-aryl-7H-imidazo[1,2-a]imidazol-3-ylmethylamines, a novel class of corticotropin-releasing factor receptor type 1 (CRF1R) antagonists.

description: Small molecule binding data for protein Corticotropin releasing factor receptor 1, Uniprot P34998
DOI: 10.7270/q2ww7hvq
title: BindingDB Entry 50031807: Discovery of a potent, orally active 11beta-hydroxysteroid dehydrogenase type 1 inhibitor for clinical study: identification of (S)-2-((1S,2S,4R)-bicyclo[2.2.1]heptan-2-ylamino)-5-isopropyl-5-methylthiazol-4(5H)-one (AMG 221).

description: Small molecule binding data for protein 11-beta-hydroxysteroid dehydrogenase 1, 11-beta-hydroxysteroid dehydrogenase 2, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Glucocorticoid receptor, Uniprot P04150, P05177, P08684, P10635, P11712, P28845, P33261, and P80365
DOI: 10.7270/q21j99rf
title: BindingDB Entry 50029889: TBA

description: Small molecule binding data for protein COX-1 and COX-2, Uniprot P35355 and Q63921
DOI: 10.7270/q22f7nnr
title: BindingDB Entry 50031833: Dihydro-pyrano[2,3-b]pyridines and tetrahydro-1,8-naphthyridines as CB1 receptor inverse agonists: synthesis, SAR and biological evaluation.

description: Small molecule binding data for protein Cannabinoid receptor 1, Cannabinoid receptor 2, and Voltage-gated potassium channel, Uniprot P21554, P34972, and Q12809
DOI: 10.7270/q23b607d
title: BindingDB Entry 50030884: 4-Oxo-beta-lactams (azetidine-2,4-diones) are potent and selective inhibitors of human leukocyte elastase.

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q23f4ptk
title: BindingDB Entry 50031824: Synthesis and evaluation of new endomorphin-2 analogues containing (Z)-alpha,beta-didehydrophenylalanine (Delta(Z)Phe) residues.

description: Small molecule binding data for protein Delta-type opioid receptor, Nociceptin/mu opioid receptor, and mu/kappa opioid receptor, Uniprot P32300, P33535, P41143, and P97266
DOI: 10.7270/q25b02gq
title: BindingDB Entry 50029888: TBA

description: Small molecule binding data for protein COX-1 and COX-2, Uniprot P35355 and Q63921
DOI: 10.7270/q25x28vr
title: BindingDB Entry 50028860: TBA

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P22303
DOI: 10.7270/q2668d84
title: BindingDB Entry 50030894: Synthesis and opioid receptor binding affinities of 2-substituted and 3-aminomorphinans: ligands for mu, kappa, and delta opioid receptors.

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, and Mu-type opioid receptor, Uniprot P35372, P41143, and P41145