cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2xk8fmb
title: BindingDB Entry 50030673: Discovery of novel benzoxazinones as potent and orally active long chain fatty acid elongase 6 inhibitors.

description: Small molecule binding data for protein Elongation of very long chain fatty acids protein 1, Elongation of very long chain fatty acids protein 2, Elongation of very long chain fatty acids protein 3, Elongation of very long chain fatty acids protein 5, and Elongation of very long chain fatty acids protein 6, Uniprot O35949, Q920L5, Q9BW60, Q9H5J4, Q9HB03, Q9NXB9, and Q9NYP7
DOI: 10.7270/q2xp74r2
title: BindingDB Entry 50026564: A three-step synthesis from rebeccamycin of an efficient checkpoint kinase 1 inhibitor.

description: Small molecule binding data for protein Serine/threonine-protein kinase Chk1, Uniprot O14757
DOI: 10.7270/q2057fsp
title: BindingDB Entry 50028468: In vitro and in vivo SAR of pyrido[3,4-d]pyramid-4-ylamine based mGluR1 antagonists.

description: Small molecule binding data for protein Metabotropic glutamate receptor 1, Metabotropic glutamate receptor 5, and metabotropic glutamate 1/2, Uniprot P23385, P41594, and Q13255
DOI: 10.7270/q21c1wzd
title: BindingDB Entry 50030680: Synthesis of aryl phosphates based on pyrimidine and triazine scaffolds.

description: Small molecule binding data for protein Grb2-SH2, Uniprot P62993
DOI: 10.7270/q21g0m23
title: BindingDB Entry 50026582: Inhibition of acetylcholinesterase, beta-amyloid aggregation, and NMDA receptors in Alzheimer's disease: a promising direction for the multi-target-directed ligands gold rush.

description: Small molecule binding data for protein Acetylcholinesterase, Cholinesterase, and NMDA, Uniprot P06276, P22303, and Q05586
DOI: 10.7270/q23778qb
title: BindingDB Entry 50029664: TBA

description: Small molecule binding data for protein Arachidonate 5-lipoxygenase and Platelet activating factor receptor, Uniprot P12527 and P25105
DOI: 10.7270/q2445mjr
title: BindingDB Entry 50030690: Efficient microwave combinatorial synthesis of novel indolic arylpiperazine derivatives as serotoninergic ligands.

description: Small molecule binding data for protein DOPAMINE, Serotonin (5-HT) receptor, and Serotonin receptor 2a and 2c (5HT2A and 5HT2C), Uniprot P08909, P14842, P18901, and P19327
DOI: 10.7270/q2542np4
title: BindingDB Entry 50030679: Discovery of a 2,4-diamino-7-aminoalkoxyquinazoline as a potent and selective inhibitor of histone lysine methyltransferase G9a.

description: Small molecule binding data for protein Histone-lysine N-methyltransferase EHMT1 and Protein G9a (G9a), Uniprot Q96KQ7 and Q9H9B1
DOI: 10.7270/q2571bsd
title: BindingDB Entry 50026579: Highly specific and broadly potent inhibitors of mammalian secreted phospholipases A2.

description: Small molecule binding data for protein Group IID secretory phospholipase A2, Group IIE secretory phospholipase A2, Group IIF secretory phospholipase A2, Group X secretory phospholipase A2, Phospholipase A2, Phospholipase A2 group 1B, Phospholipase A2 group V, Phospholipase A2, membrane associated, and Secretory phospholipase A2, group V (sPLA2-V), Uniprot O15496, P04054, P14555, P31482, P39877, P97391, Q3UG05, Q9BZM2, Q9NZK7, Q9QUL3, Q9QXX3, Q9QZT4, Q9UNK4, Q9WVF6, and Q9Z0Y2
DOI: 10.7270/q27081dm
title: BindingDB Entry 50029660: TBA

description: Small molecule binding data for protein Endothelin receptor, ET-A/ET-B, Uniprot P24530 and P25101
DOI: 10.7270/q27p8z8w
title: BindingDB Entry 50028463: Diphenyl ethers as androgen receptor antagonists for the topical suppression of sebum production.

description: Small molecule binding data for protein Androgen Receptor, Uniprot P10275
DOI: 10.7270/q27w6c85
title: BindingDB Entry 50030689: Synthesis and AChE inhibitory activity of new chiral tetrahydroacridine analogues from terpenic cyclanones.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P37136
DOI: 10.7270/q29023k1
title: BindingDB Entry 50026576: The discovery of small molecule chemical probes of Bcl-X(L) and Mcl-1.

description: Small molecule binding data for protein GST-BAD and Induced myeloid leukemia cell differentiation protein Mcl-1 homolog, Uniprot P97287 and Q61337
DOI: 10.7270/q2br8s53
title: BindingDB Entry 50029659: TBA

description: Small molecule binding data for protein Trypsin I, Uniprot P00760
DOI: 10.7270/q2cf9pzr
title: BindingDB Entry 50028462: Synthesis and anti-inflammatory activity of the major metabolites of imrecoxib.

description: Small molecule binding data for protein Cyclooxygenase, Cyclooxygenase-1 (COX-1), Cyclooxygenase-2 (COX-2), and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P22437, P23219, P35354, and Q05769
DOI: 10.7270/q2cn740w
title: BindingDB Entry 50030688: A strategy to minimize reactive metabolite formation: discovery of (S)-4-(1-cyclopropyl-2-methoxyethyl)-6-[6-(difluoromethoxy)-2,5-dimethylpyridin-3-ylamino]-5-oxo-4,5-dihydropyrazine-2-carbonitrile as a potent, orally bioavailable corticotropin-releasing factor-1 receptor antagonist.

description: Small molecule binding data for protein Corticotropin releasing factor receptor and Corticotropin releasing factor receptor 1, Uniprot P34998 and P35353
DOI: 10.7270/q2dr2v92
title: BindingDB Entry 50026568: Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1.

description: Small molecule binding data for protein trace amine-associated receptor 1, Uniprot Q96RJ0
DOI: 10.7270/q2fj2grk
title: BindingDB Entry 50029669: TBA

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q2gh9hz9
title: BindingDB Entry 50029657: TBA

description: Small molecule binding data for protein Neurokinin 1 receptor, Uniprot P25103
DOI: 10.7270/q2h41rbm
title: BindingDB Entry 50028459: Fluorinated non-imidazole histamine H3 receptor antagonists.

description: Small molecule binding data for protein Histamine receptor (H3), Uniprot Q9Y5N1
DOI: 10.7270/q2hd7vqt
title: BindingDB Entry 50030686: Identification and characterisation of new inhibitors for the human hematopoietic prostaglandin D2 synthase.

description: Small molecule binding data for protein Prostaglandin D Synthase, Uniprot O60760
DOI: 10.7270/q2jh3m0b
title: BindingDB Entry 50026567: Biphenyl amide p38 kinase inhibitors 4: DFG-in and DFG-out binding modes.

description: Small molecule binding data for protein C-RAF, Heat shock protein beta-1, MAP kinase p38, Mitogen-activated protein kinase 10, Mitogen-activated protein kinase 14, Platelet-derived growth factor receptor, SRC, Serine/threonine-protein kinase 10, Serine/threonine-protein kinase 2, TRAF2 and NCK-interacting protein kinase (TNIK), Tyrosine-protein kinase Kit (Kit), Tyrosine-protein kinase LCK, Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2), and c-Jun N-terminal kinase, JNK, Uniprot O94804, P04049, P04792, P06239, P06240, P07948, P10721, P16234, P45983, P53779, Q02763, Q15759, Q16539, Q9H2G2, and Q9UKE5
DOI: 10.7270/q2mw2h1k
title: BindingDB Entry 50028457: IKKbeta inhibitors identification part I: homology model assisted structure based virtual screening.

description: Small molecule binding data for protein Inhibitor of NF-kappa-B kinase (IKK), Uniprot O14920
DOI: 10.7270/q2n29x17
title: BindingDB Entry 50030684: Potent and orally active small-molecule inhibitors of the MDM2-p53 interaction.

description: Small molecule binding data for protein E3 ubiquitin-protein ligase Mdm2, Uniprot Q00987
DOI: 10.7270/q2n879mq
title: BindingDB Entry 50026593: Naturally occurring homoisoflavonoids function as potent protein tyrosine kinase inhibitors by c-Src-based high-throughput screening.

description: Small molecule binding data for protein Ephrin receptor, Epidermal growth factor receptor, Epidermal growth factor receptor and ErbB2 (HER1 and HER2), Fibroblast growth factor receptor 1, Hepatocyte growth factor receptor, Tyrosine-protein kinase Kit (Kit), VEGF-receptor 2 and tyrosine-protein kinase SRC, Vascular endothelial growth factor receptor, and Vascular endothelial growth factor receptor 2, Uniprot L7RSL3, P00533, P04626, P08581, P10721, P11362, P12931, P17948, P29323, and P35968
DOI: 10.7270/q2p84bqn
title: BindingDB Entry 50026566: Synthesis and structure-activity relationship of 1H-indole-3-carboxylic acid pyridine-3-ylamides: a novel series of 5-HT2C receptor antagonists.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), 5-Hydroxytryptamine receptor 6 (5-HT6), 5-Hydroxytryptamine receptor 7 (5-HT7), 5-hydroxytryptamine receptor 1A, Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, and Dopamine receptors; D2 & D4, Uniprot P08908, P14416, P21917, P28223, P28335, P34969, P35462, and P50406
DOI: 10.7270/q2q2407g
title: BindingDB Entry 50029667: TBA

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q2r211cv
title: BindingDB Entry 50029654: TBA

description: Small molecule binding data for protein Potassium-transporting ATPase, Uniprot P19156
DOI: 10.7270/q2rn37qf
title: BindingDB Entry 50028455: Piperidinyl-2-phenethylamino inhibitors of DPP-IV for the treatment of type 2 diabetes.

description: Small molecule binding data for protein Dipeptidyl peptidase 2 (DPP II), Dipeptidyl peptidase 4 (DPP4), and Voltage-gated potassium channel, Uniprot P27487, Q12809, and Q9UHL4
DOI: 10.7270/q2rv0nrs
title: BindingDB Entry 50030683: Identification of a brain penetrant PDE9A inhibitor utilizing prospective design and chemical enablement as a rapid lead optimization strategy.

description: Small molecule binding data for protein Phosphodiesterase 11A (PDE11A), Phosphodiesterase 1C (PDE1C), Phosphodiesterase 3 (PDE3), Phosphodiesterase 8, Phosphodiesterase 9A, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4C, cAMP-specific 3',5'-cyclic phosphodiesterase 7B, and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O76074, O76083, O95263, Q08493, Q14123, Q14432, Q9HCR9, Q9NP56, and Q9Y233
DOI: 10.7270/q2s182bf
title: BindingDB Entry 50026589: Synthesis and cytotoxic, anti-inflammatory, and anti-oxidant activities of 2',5'-dialkoxylchalcones as cancer chemopreventive agents.

description: Small molecule binding data for protein Xanthine oxidase, Uniprot P47989
DOI: 10.7270/q2tt4qxn
title: BindingDB Entry 50029666: TBA

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q2vt1s2f
title: BindingDB Entry 50029653: TBA

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase-1 (MMP1), and Stromelysin-1, Uniprot P03956, P08253, and P08254
DOI: 10.7270/q2wd40f5
title: BindingDB Entry 50028454: Regioisomerism-dependent TLR7 agonism and antagonism in an imidazoquinoline.

description: Small molecule binding data for protein Toll-like receptor 7 (TLR7), Uniprot Q9NYK1
DOI: 10.7270/q2wm1dgh
title: BindingDB Entry 50030682: Morpholine derivatives greatly enhance the selectivity of mammalian target of rapamycin (mTOR) inhibitors.

description: Small molecule binding data for protein PI3-kinase subunit alpha, PI3-kinase subunit beta, PI3-kinase subunit delta, and Serine/threonine-protein kinase mTOR, Uniprot O00329, P42336, P42338, and P42345
DOI: 10.7270/q2zk5gmx
title: BindingDB Entry 50029665: TBA

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 4 (5-HT4), Adenosine receptor A2b, Adrenergic receptor alpha-1, Dopamine D2 receptor and serotonin 1a receptor, Dopamine receptor D2L/neurotensin receptor NTS1, Histamine H1 receptor, Muscarinic acetylcholine receptor M2 and M4, Serotonin (5-HT) receptor, Serotonin 1d (5-HT1d) receptor, Serotonin 2 (5-HT2) receptor, Serotonin 3 (5-HT3) receptor, and Serotonin receptor 2a and 2c (5HT2A and 5HT2C), Uniprot P08173, P08908, P08909, P14416, P25100, P28221, P28223, P28335, P29276, P35348, P35367, P35368, P41595, P46098, Q13639, and Q60484
DOI: 10.7270/q20c4vt1
title: BindingDB Entry 50030691: Radiosynthesis and radiopharmacological evaluation of cyclin-dependent kinase 4 (Cdk4) inhibitors.

description: Small molecule binding data for protein Cyclin-dependent kinase 1 and Cyclin-dependent kinase 2, Uniprot P06493 and P24941
DOI: 10.7270/q20k28cg
title: BindingDB Entry 50026609: Design, synthesis and evaluation of novel uracil acetamide derivatives as potential inhibitors of Plasmodium falciparum dUTP nucleotidohydrolase.

description: Small molecule binding data for protein Deoxyuridine 5'-triphosphate nucleotidohydrolase (dUTPase) and dUTP pyrophosphatase, Uniprot P33316 and Q8II92
DOI: 10.7270/q22b8z09
title: BindingDB Entry 50029672: TBA

description: Small molecule binding data for protein Glucocerebrosidase (Acid beta-Glucosidase), Uniprot P04062
DOI: 10.7270/q22z15f5
title: BindingDB Entry 50028480: Discovery of betrixaban (PRT054021), N-(5-chloropyridin-2-yl)-2-(4-(N,N-dimethylcarbamimidoyl)benzamido)-5-methoxybenzamide, a highly potent, selective, and orally efficacious factor Xa inhibitor.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Plasminogen, Prothrombin, Tissue-type plasminogen activator, Vitamin K-dependent protein C, and Voltage-gated potassium channel, Uniprot P00734, P00742, P00747, P00750, P04070, and Q12809
DOI: 10.7270/q2348kdc
title: BindingDB Entry 50030701: Application of fragment-based NMR screening, X-ray crystallography, structure-based design, and focused chemical library design to identify novel microM leads for the development of nM BACE-1 (beta-site APP cleaving enzyme 1) inhibitors.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q23x86h3
title: BindingDB Entry 50028464: Synthesis and evaluation of 2,7-diamino-thiazolo[4,5-d] pyrimidine analogues as anti-tumor epidermal growth factor receptor (EGFR) tyrosine kinase inhibitors.

description: Small molecule binding data for protein Cyclin-dependent kinase 1 and Epidermal growth factor receptor, Uniprot P00533 and P06493
DOI: 10.7270/q24749pg
title: BindingDB Entry 50026607: Imidazole piperazines: SAR and development of a potent class of cyclin-dependent kinase inhibitors with a novel binding mode.

description: Small molecule binding data for protein Cyclin-dependent kinase 2 and Voltage-gated potassium channel, Uniprot P24941 and Q12809
DOI: 10.7270/q2611097
title: BindingDB Entry 50029671: TBA

description: Small molecule binding data for protein Angiotensin-Converting Enzyme 2 and Neutral Endopeptidase (NEP), Uniprot P07861, P12821, and Q9BYF1
DOI: 10.7270/q26q1x5h
title: BindingDB Entry 50028479: Synthesis of celecoxib analogues possessing a N-difluoromethyl-1,2-dihydropyrid-2-one 5-lipoxygenase pharmacophore: biological evaluation as dual inhibitors of cyclooxygenases and 5-lipoxygenase with anti-inflammatory activity.

description: Small molecule binding data for protein Cyclooxygenase and Cyclooxygenase-2, Uniprot O62664, O62698, and P35354
DOI: 10.7270/q26w9b4s
title: BindingDB Entry 50030700: Discovery of cyclic acylguanidines as highly potent and selective beta-site amyloid cleaving enzyme (BACE) inhibitors: Part I--inhibitor design and validation.

description: Small molecule binding data for protein Beta-secretase 1 and Cathepsin D, Uniprot P07339 and P56817
DOI: 10.7270/q28052d6
title: BindingDB Entry 50026602: Exploring 9-benzyl purines as inhibitors of glutamate racemase (MurI) in Gram-positive bacteria.

description: Small molecule binding data for protein Glutamate racemase, Uniprot Q836J0
DOI: 10.7270/q29s1r0t
title: BindingDB Entry 50029670: TBA

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q2bg2nx8
title: BindingDB Entry 50028475: Novel peptidomimetics containing a vinyl ester moiety as highly potent and selective falcipain-2 inhibitors.

description: Small molecule binding data for protein Cathepsin (B and K) and Cathepsin L1, Uniprot P07711 and P07858
DOI: 10.7270/q2bp02vn
title: BindingDB Entry 50030699: Optimization of a pipemidic acid autotaxin inhibitor.

description: Small molecule binding data for protein Autotaxin, Uniprot Q13822
DOI: 10.7270/q2cr5t5p
title: BindingDB Entry 50026601: Biphenyl amide p38 kinase inhibitors 3: Improvement of cellular and in vivo activity.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, MAP kinase p38, and Mitogen-activated protein kinase 14, Uniprot P05177, P08684, P10635, P11712, P33261, Q15759, and Q16539
DOI: 10.7270/q2g73dmj
title: BindingDB Entry 50028474: Substituted terphenyl compounds as the first class of low molecular weight allosteric inhibitors of the luteinizing hormone receptor.

description: Small molecule binding data for protein Luteinizing hormone/Choriogonadotropin receptor, Uniprot P22888
DOI: 10.7270/q2gf0tk0
title: BindingDB Entry 50030695: Janus kinase 2 inhibitors. Synthesis and characterization of a novel polycyclic azaindole.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, JAK3/JAK1, Mitogen-activated protein kinase 2, Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase Kit (Kit), Uniprot O60674, P10721, P52333, Q12851, and Q9UM73
DOI: 10.7270/q2gh9hrm
title: BindingDB Entry 50026621: Derivatives of (3S)-N-(biphenyl-2-ylmethyl)pyrrolidin-3-amine as selective noradrenaline reuptake inhibitors: Reducing P-gp mediated efflux by modulation of H-bond acceptor capacity.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), Cytochrome P450 1A, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Muscarinic acetylcholine receptor, Serotonin and norepinephrine transporters (SERT/NET), Serotonin receptor (2b and 2c), Sodium-dependent dopamine transporter, Sodium-dependent noradrenaline transporter, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P20309, P23975, P28223, P28335, P31645, P41595, Q01959, and Q12809
DOI: 10.7270/q2hh6jw0
title: BindingDB Entry 50026599: Discovery of imidazole carboxamides as potent and selective CCK1R agonists.

description: Small molecule binding data for protein Cholecystokinin receptor, Uniprot P32238, P32239, and P56481
DOI: 10.7270/q2k937hr
title: BindingDB Entry 50029668: TBA

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q2m0459t
title: BindingDB Entry 50028472: N(epsilon)-thioacetyl-lysine-containing tri-, tetra-, and pentapeptides as SIRT1 and SIRT2 inhibitors.

description: Small molecule binding data for protein NAD-Dependent Deacetylase Sirtuin-1 and NAD-dependent deacetylase sirtuin 2, Uniprot Q8IXJ6 and Q96EB6
DOI: 10.7270/q2m61k9q
title: BindingDB Entry 50030694: N-sulfonylanthranilic acid derivatives as allosteric inhibitors of dengue viral RNA-dependent RNA polymerase.

description: Small molecule binding data for protein DNA polymerase (alpha/delta/epsilon) and DNA polymerase beta, Uniprot P06746 and P09884
DOI: 10.7270/q2p26z3q
title: BindingDB Entry 50029677: TBA

description: Small molecule binding data for protein Cyclooxygenase and Cyclooxygenase-1 (COX-1), Uniprot P23219 and P35354
DOI: 10.7270/q2qn66nz
title: BindingDB Entry 50028471: Novel approach for chemotype hopping based on annotated databases of chemically feasible fragments and a prospective case study: new melanin concentrating hormone antagonists.

description: Small molecule binding data for protein Melanin-concentrating hormone receptor and Voltage-gated potassium channel, Uniprot Q12809 and Q99705
DOI: 10.7270/q2qv3mkz
title: BindingDB Entry 50030693: Antiviral potential and molecular insight into neuraminidase inhibiting diarylheptanoids from Alpinia katsumadai.

description: Small molecule binding data for protein Neuraminidase A, Uniprot P03468
DOI: 10.7270/q2st7ptq
title: BindingDB Entry 50029676: TBA

description: Small molecule binding data for protein Type 1 InsP3 receptor isoform S2
DOI: 10.7270/q2td9x8c
title: BindingDB Entry 50028484: Carbonic anhydrase inhibitors. Inhibition of the beta-class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with aliphatic and aromatic carboxylates.

description: Small molecule binding data for protein Carbonic anhydrase 2 and beta-Carbonic Anhydrase, Uniprot P00918 and Q5AJ71
DOI: 10.7270/q2tm7b59
title: BindingDB Entry 50030705: Synthesis and in vitro evaluation of N-substituted maleimide derivatives as selective monoglyceride lipase inhibitors.

description: Small molecule binding data for protein Fatty-acid amide hydrolase 1 (FAAH) and Monoglyceride Lipase (MGL), Uniprot O00519 and Q99685
DOI: 10.7270/q2vd6z9d
title: BindingDB Entry 50028470: Comparison of N-terminal modifications on neurotensin(8-13) analogues correlates peptide stability but not binding affinity with in vivo efficacy.

description: Small molecule binding data for protein Dopamine receptor D2L/neurotensin receptor NTS1 and Neurotensin receptor 1, Uniprot O88319 and P30989
DOI: 10.7270/q2vm4c9p
title: BindingDB Entry 50030692: P2'-truncated BACE-1 inhibitors with a novel hydroxethylene-like core.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2vt1rx7
title: BindingDB Entry 50026612: Novel indoline-based acyl-CoA:cholesterol acyltransferase inhibitor with antiperoxidative activity: improvement of physicochemical properties and biological activities by introduction of carboxylic acid.

description: Small molecule binding data for protein Acyl Cholesterol Acyltransferase 1 (ACAT-1), Uniprot P35610
DOI: 10.7270/q2ws8t2g
title: BindingDB Entry 50026587: 2-Alkenylthieno[2,3-b]pyridine-5-carbonitriles: Potent and selective inhibitors of PKCtheta.

description: Small molecule binding data for protein Aurora kinase B/Inner centromere protein, Casein kinase I, Cyclin-dependent kinase 1, Hepatocyte growth factor receptor, Inhibitor of NF-kappa-B kinase (IKK), MAP kinase ERK2, MAP kinase-activated protein kinase 2, Mitogen-activated protein kinase 14, PKC alpha and beta-2, Platelet-derived growth factor receptor, Protein kinase C (PKC), Protein kinase C alpha type, Protein kinase C delta type, Protein kinase C theta type, Protein kinase C, epsilon, Protein kinase C, eta, Rho-associated protein kinase, Ribosomal protein S6 kinase alpha 1, SRC, Serine/threonine-protein kinase Chk1, Tyrosine-protein kinase ITK/TSK, VEGF-receptor 2 and tyrosine-protein kinase SRC, and Vascular endothelial growth factor receptor 2, Uniprot O14757, O14920, O15111, P05771, P06239, P06241, P06493, P07948, P08581, P08631, P12931, P16234, P17252, P24723, P28482, P35968, P49137, Q02156, Q04759, Q05513, Q05655, Q08881, Q13464, Q15418, Q16539, Q96GD4, and Q9HCP0
DOI: 10.7270/q2xk8fjf
title: BindingDB Entry 50029675: TBA

description: Small molecule binding data for protein Potassium-transporting ATPase alpha chain 2, Uniprot P54707
DOI: 10.7270/q2z60nzs
title: BindingDB Entry 50028483: Anthranilamide-based N,N-dialkylbenzamidines as potent and orally bioavailable factor Xa inhibitors: P4 SAR.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Plasminogen, Prothrombin, and Tissue-type plasminogen activator, Uniprot P00734, P00742, P00747, and P00750
DOI: 10.7270/q2zc82wm
title: BindingDB Entry 50030703: Functionalized congeners of A3 adenosine receptor-selective nucleosides containing a bicyclo[3.1.0]hexane ring system.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2a and A3, and Adenosine receptor A3, Uniprot P0DMS8, P28647, P29274, and P30542
DOI: 10.7270/q21c1wwh
title: BindingDB Entry 50029683: TBA

description: Small molecule binding data for protein Renin, Uniprot P00797