cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2319x0g
title: BindingDB Entry 50040191: Inhibition ofa-class cytosolic human carbonic anhydrases I, II, IX and XII, andß-class fungal enzymes by carboxylic acids and their derivatives: new isoform-I selective nanomolar inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase, Carbonic anhydrase 12, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, and Q16790
DOI: 10.7270/q25t3mv7
title: BindingDB Entry 50042932: Development of highly potent and selective diaminothiazole inhibitors of cyclin-dependent kinases.

description: Small molecule binding data for protein CDK3/E, CDK9/Cyclin K, Cyclin-Dependent Kinase 1 (CDK1), Cyclin-Dependent Kinase 5 (CDK5), Cyclin-Dependent Kinase 7 (CDK7), Cyclin-K, and Cyclin-dependent kinase 6/G1/S-specific cyclin D1, Uniprot O75909, P06493, P20248, P24385, P24864, P50613, P50750, P51946, Q00526, Q00534, Q00535, and Q15078
DOI: 10.7270/q25x2b45
title: BindingDB Entry 50041151: Leukotriene receptor antagonists. 2. The [[(tetrazol-5-ylaryl)oxy]methyl]acetophenone derivatives.

description: Small molecule binding data for protein Cysteinyl leukotriene receptor 1, Uniprot Q2NNR5
DOI: 10.7270/q26t0nrg
title: BindingDB Entry 50040190: Discovery of 6-substituted 4-anilinoquinazolines with dioxygenated rings as novel EGFR tyrosine kinase inhibitors.

description: Small molecule binding data for protein Epidermal growth factor receptor, Epidermal growth factor receptor and ErbB2 (HER1 and HER2), and Vascular endothelial growth factor receptor 2, Uniprot P00533, P04626, and P35968
DOI: 10.7270/q28053vf
title: BindingDB Entry 50041898: Benzimidazole-2-pyrazole HIF Prolyl 4-Hydroxylase Inhibitors as Oral Erythropoietin Secretagogues.

description: Small molecule binding data for protein Egl nine homolog 1, Uniprot Q9GZT9
DOI: 10.7270/q29k4cmd
title: BindingDB Entry 50042931: Antibacterial oxazolidinone analogues having a N-hydroxyacetyl-substituted seven-membered [1,2,5]triazepane or [1,2,5]oxadiazepane C-ring unit.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C9, and Cytochrome P450 2D6 (2D6), Uniprot P05177, P10635, and P11712
DOI: 10.7270/q2b56m22
title: BindingDB Entry 50042420: The 2.5Å crystal structure of the SIRT1 catalytic domain bound to nicotinamide adenine dinucleotide (NAD+) and an indole (EX527 analogue) reveals a novel mechanism of histone deacetylase inhibition.

description: Small molecule binding data for protein NAD-Dependent Deacetylase Sirtuin-1, Uniprot Q96EB6
DOI: 10.7270/q2bk1dfr
title: BindingDB Entry 50040189: N-Benzoyl anthranilic acid derivatives as selective inhibitors of aldo-keto reductase AKR1C3.

description: Small molecule binding data for protein 17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3), Aldo-keto reductase family 1 member C1, Aldo-keto reductase family 1 member C2, and Aldo-keto reductase family 1 member C4 (AK1C4), Uniprot P17516, P42330, P52895, and Q04828
DOI: 10.7270/q2cn755j
title: BindingDB Entry 50041897: hNK2 receptor antagonists. The use of intramolecular hydrogen bonding to increase solubility and membrane permeability.

description: Small molecule binding data for protein Neurokinin 2 receptor, Uniprot P21452
DOI: 10.7270/q2ff3tjc
title: BindingDB Entry 50041149: Quantitative structure-activity relationships and eudismic analyses of the presynaptic dopaminergic activity and dopamine D2 and sigma receptor affinities of 3-(3-hydroxyphenyl)piperidines and octahydrobenzo[f]quinolines.

description: Small molecule binding data for protein Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor and OPIATE Sigma, Uniprot P61169 and Q9R0C9
DOI: 10.7270/q2fx7brm
title: BindingDB Entry 50042419: Probing the steric requirements of the¿-aminobutyric acid aminotransferase active site with fluorinated analogues of vigabatrin.

description: Small molecule binding data for protein Gamma-amino-N-butyrate transaminase, Uniprot P80147
DOI: 10.7270/q2g73ftn
title: BindingDB Entry 50040188: Synthesis and structure-activity relationship of 4-(1,3-benzothiazol-2-yl)-thiophene-2-sulfonamides as cyclin-dependent kinase 5 (cdk5)/p25 inhibitors.

description: Small molecule binding data for protein Cyclin-Dependent Kinase 5 (CDK5), Uniprot Q00535 and Q15078
DOI: 10.7270/q2hd7wwg
title: BindingDB Entry 50041896: Discovery of potent and orally bioavailable heterocycle-based cannabinoid CB1 receptor agonists.

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/q2ht2qg8
title: BindingDB Entry 50040652: Factors influencing the specificity of inhibitor binding to the human and malaria parasite dihydroorotate dehydrogenases.

description: Small molecule binding data for protein Dihydroorotate dehydrogenase, Uniprot Q02127
DOI: 10.7270/q2m046hx
title: BindingDB Entry 50040187: Antiplasmodial activities of 4-aminoquinoline-statine compounds.

description: Small molecule binding data for protein Cathepsin D and Plasmepsin 2, Uniprot P07339 and P46925
DOI: 10.7270/q2n58nm6
title: BindingDB Entry 50041895: Discovery of a potent, orally bioavailable pyrimidine VLA-4 antagonist effective in a sheep asthma model.

description: Small molecule binding data for protein Fibronectin receptor beta/Integrin alpha-4, Uniprot P05556 and P13612
DOI: 10.7270/q2nk3g5j
title: BindingDB Entry 50040651: Discovery and optimization of a series of 3-(3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amines: orally bioavailable, selective, and potent ATP-independent Akt inhibitors.

description: Small molecule binding data for protein AKT/p21CIP1, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Serine/threonine-protein kinase AKT, Uniprot P05177, P08684, P10632, P10635, P11712, P31749, P31751, P33261, and Q9Y243
DOI: 10.7270/q2nv9kmn
title: BindingDB Entry 50042936: Discovery of SAR184841, a potent and long-lasting inhibitor of 11ß-hydroxysteroid dehydrogenase type 1, active in a physiopathological animal model of T2D.

description: Small molecule binding data for protein 11-beta-Hydroxysteroid Dehydrogenase 1 (11-beta-HSD1), 11-beta-hydroxysteroid dehydrogenase 1, and 11-beta-hydroxysteroid dehydrogenase 2, Uniprot P16232, P28845, P50172, and P80365
DOI: 10.7270/q2qc04tb
title: BindingDB Entry 50042417: Fragment growing and linking lead to novel nanomolar lactate dehydrogenase inhibitors.

description: Small molecule binding data for protein Lactate dehydrogenase A (LDHA), Uniprot P00338
DOI: 10.7270/q2s75hgj
title: BindingDB Entry 50040650: Structure-based design of novel inhibitors of the MDM2-p53 interaction.

description: Small molecule binding data for protein CREB-binding protein/p53 and E3 ubiquitin-protein ligase Mdm2, Uniprot P04637 and Q00987
DOI: 10.7270/q2v40wh7
title: BindingDB Entry 50042416: Identification of GZD824 as an orally bioavailable inhibitor that targets phosphorylated and nonphosphorylated breakpoint cluster region-Abelson (Bcr-Abl) kinase and overcomes clinically acquired mutation-induced resistance against imatinib.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2C9, and Tyrosine-protein kinase ABL1, Uniprot P00519, P11712, and P33261
DOI: 10.7270/q2x0685t
title: BindingDB Entry 50040649: Discovery of novel potent and highly selective glycogen synthase kinase-3ß (GSK3ß) inhibitors for Alzheimer's disease: design, synthesis, and characterization of pyrazines.

description: Small molecule binding data for protein Glycogen synthase kinase-3 and Glycogen synthase kinase-3 beta, Uniprot P49841 and Q9WV60
DOI: 10.7270/q2xd12vj
title: BindingDB Entry 50041153: Evaluation of the side arm of (naphthylvinyl)pyridinium inhibitors of choline acetyltransferase.

description: Small molecule binding data for protein Acetylcholinesterase and Choline Acetyltransferase, Uniprot P32738 and P37136
DOI: 10.7270/q20g3mdd
title: BindingDB Entry 50041900: Triazole ligands reveal distinct molecular features that induce histamine H4 receptor affinity and subtly govern H4/H3 subtype selectivity.

description: Small molecule binding data for protein Histamine receptor (H3) and Histamine receptor (H4), Uniprot Q9H3N8 and Q9Y5N1
DOI: 10.7270/q20r9qh1
title: BindingDB Entry 50040656: Discovery of ITX 4520: a highly potent orally bioavailable hepatitis C virus entry inhibitor.

description: Small molecule binding data for protein Scavenger receptor class B member 1 and Voltage-gated potassium channel, Uniprot Q12809 and Q8WTV0
DOI: 10.7270/q22n53kj
title: BindingDB Entry 50042422: Synthesis of derivatives of the keto-pyrrolyl-difluorophenol scaffold: some structural aspects for aldose reductase inhibitory activity and selectivity.

description: Small molecule binding data for protein Aldose reductase, Uniprot P07943
DOI: 10.7270/q2474c44
title: BindingDB Entry 50041899: A QSAR study using MTD method and Dragon descriptors for a series of selective ligands ofa2C adrenoceptor.

description: Small molecule binding data for protein Alpha-2C adrenergic receptor, Uniprot P18825 and Q4W594
DOI: 10.7270/q24j0g79
title: BindingDB Entry 50040655: Design and discovery of 6-[(3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl]-1-(tetrahydro-2H-pyran-4-yl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (PF-04447943), a selective brain penetrant PDE9A inhibitor for the treatment of cognitive disorders.

description: Small molecule binding data for protein Phosphodiesterase 1C (PDE1C), Phosphodiesterase 3 (PDE3), Phosphodiesterase 8, Phosphodiesterase 9A, 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, and Q9NP56
DOI: 10.7270/q24x590s
title: BindingDB Entry 50041159: Approaches to protection against nerve agent poisoning. (Naphthylvinyl)pyridine derivatives as potential antidotes.

description: Small molecule binding data for protein Acetylcholinesterase and Choline acetylase, Uniprot P28329 and P37136
DOI: 10.7270/q26d5v9w
title: BindingDB Entry 50042421: Highly selective 2,4-diaminopyrimidine-5-carboxamide inhibitors of Sky kinase.

description: Small molecule binding data for protein AKT/p21CIP1, AXL receptor tyrosine kinase, CDK2/Cyclin A/Cyclin A1, Casein kinase I isoform delta, Epidermal growth factor receptor, Fibroblast growth factor receptor 1, Glycogen synthase kinase-3, Hepatocyte growth factor receptor, IKK epsilon/TBK1, Inhibitor of NF-kappa-B kinase (IKK), Insulin receptor, MAP kinase ERK2, MAP kinase-activated protein kinase 2, MER intracellular domain/EGFR extracellular domain chimera, Neurotrophic tyrosine kinase receptor, Protein kinase C (PKC), Pyruvate dehydrogenase kinase isoenzyme 1 (PDK1), SRC, Serine/threonine-protein kinase Aurora, Serine/threonine-protein kinase CHK2, Serine/threonine-protein kinase Chk1, Serine/threonine-protein kinase PAK 4, Serine/threonine-protein kinase PIM, Serine/threonine-protein kinase Sgk1, Serine/threonine-protein kinase TAO3, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase BTK, Tyrosine-protein kinase receptor TYRO3, VEGF-receptor 2 and tyrosine-protein kinase SRC, and Vascular endothelial growth factor receptor 2, Uniprot O00141, O14757, O14920, O14965, O96013, O96017, P00519, P00533, P04629, P06213, P06239, P08581, P11362, P12931, P20248, P24941, P28482, P30530, P31749, P35968, P48730, P49137, P49841, P78396, Q05513, Q06187, Q06418, Q12866, Q14164, Q15118, Q9H2K8, and Q9P1W9
DOI: 10.7270/q289170g
title: BindingDB Entry 50040654: Ligand-based design, synthesis, and biological evaluation of 2-aminopyrimidines, a novel series of receptor for advanced glycation end products (RAGE) inhibitors.

description: Small molecule binding data for protein Advanced glycosylation end product-specific receptor, Uniprot Q15109
DOI: 10.7270/q28k7bfk
title: BindingDB Entry 50042939: Radiosynthesis and first evaluation in mice of [(18)F]NS14490 for molecular imaging ofa7 nicotinic acetylcholine receptors.

description: Small molecule binding data for protein Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit and Neuronal acetylcholine receptor protein alpha-7 subunit, Uniprot P17787, P36544, and P43681
DOI: 10.7270/q28p61q3
title: BindingDB Entry 50041158: 9-(trans-2',trans-3'-dihydroxycyclopent-4'-enyl) derivatives of adenine and 3-deazaadenine: potent inhibitors of bovine liver S-adenosylhomocysteine hydrolase.

description: Small molecule binding data for protein Adenosylhomocysteinase, Uniprot P23526
DOI: 10.7270/q2d21zrv
title: BindingDB Entry 50040653: Design and synthesis of a novel series of bicyclic heterocycles as potent¿-secretase modulators.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P33261, and Q12809
DOI: 10.7270/q2db8376
title: BindingDB Entry 50042938: Natural sesquiterpene lactones as inhibitors of Myb-dependent gene expression: structure-activity relationships.

description: Small molecule binding data for protein Transcriptional activator Myb, Uniprot P01103
DOI: 10.7270/q2df6sd0
title: BindingDB Entry 50041157: Inhibition of murine thymidylate synthase and human dihydrofolate reductase by 5,8-dideaza analogues of folic acid and aminopterin.

description: Small molecule binding data for protein Dihydrofolate reductase and Thymidylate synthase, Uniprot P00374 and P07607
DOI: 10.7270/q2j38tz4
title: BindingDB Entry 50042937: Development of cyclic peptomer inhibitors targeting the polo-box domain of polo-like kinase 1.

description: Small molecule binding data for protein Serine/threonine-protein kinase PLK1, Uniprot P53350
DOI: 10.7270/q2j67j4q
title: BindingDB Entry 50041156: Synthesis and beta-adrenergic antagonism of 2-(aryloxy)-1-(2-piperidyl)ethanols.

description: Small molecule binding data for protein Beta-1 adrenergic receptor and Beta-2 adrenergic receptor, Uniprot Q8K4Z4
DOI: 10.7270/q2k075cj
title: BindingDB Entry 50040195: Modulation of cofilin phosphorylation by inhibition of the Lim family kinases.

description: Small molecule binding data for protein Dual specificity testis-specific protein kinase 1, Dual specificity testis-specific protein kinase 2, LIM domain kinase 1, LIM domain kinase 2, and Mitogen-activated protein kinase 14, Uniprot P53667, P53671, Q15569, Q16539, and Q96S53
DOI: 10.7270/q2kk9d4x
title: BindingDB Entry 50042418: Discovery and evaluation of novel inhibitors of mycobacterium protein tyrosine phosphatase B from the 6-Hydroxy-benzofuran-5-carboxylic acid scaffold.

description: Small molecule binding data for protein Dual specificity protein phosphatase (VHR), Dual specificity protein phosphatase CDC14A, Dual specificity protein phosphatase VHX (VHX), Fas-associated protein-tyrosine phosphatase 1 (FAP1), Hematopoietic protein-tyrosine phosphatase (HEPTP), Laforin, Low molecular weight phosphotyrosine protein phosphatase (LMWPTP), Protein tyrosine phosphatase SHP-2 (SHP-2), Protein-tyrosine phosphatase 1B, Protein-tyrosine phosphatase 1C, Protein-tyrosine phosphatase MEG2 (PTP-Meg2), Protein-tyrosine phosphatase alpha, Receptor-type tyrosine-protein phosphatase F (LAR), Receptor-type tyrosine-protein phosphatase gamma (PTPγ), T-cell protein-tyrosine phosphatase, Tyrosine-Protein Phosphatase (CD45), and Tyrosine-protein phosphatase non-receptor type 22, Uniprot O95278, P08575, P10586, P17706, P18031, P18433, P23470, P24666, P29350, P35236, P43378, P51452, Q06124, Q12923, Q9NRW4, Q9UNH5, and Q9Y2R2
DOI: 10.7270/q2nz88t8
title: BindingDB Entry 50041155: Isoprenoid (phosphinylmethyl)phosphonates as inhibitors of squalene synthetase.

description: Small molecule binding data for protein Squalene synthetase, Uniprot Q02769
DOI: 10.7270/q2pr7x24
title: BindingDB Entry 50040194: Discovery and optimization of a series of liver X receptor antagonists.

description: Small molecule binding data for protein Liver X receptor (LXR alpha AND LXR beta), Uniprot P55055
DOI: 10.7270/q2qz2c6s
title: BindingDB Entry 50041902: Exploration of new scaffolds as potential MAO-A inhibitors using pharmacophore and 3D-QSAR based in silico screening.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A, Uniprot P21397
DOI: 10.7270/q2sj1n1z
title: BindingDB Entry 50042935: Pyridinylquinazolines selectively inhibit human methionine aminopeptidase-1 in cells.

description: Small molecule binding data for protein Methionine Aminopeptidase Type 1 (MetAP1) and Methionine aminopeptidase 2, Uniprot P50579 and P53582
DOI: 10.7270/q2sn0b5p
title: BindingDB Entry 50041154: (Phosphinyloxy)acyl amino acid inhibitors of angiotensin converting enzyme (ACE). 1. Discovery of (S)-1-[6-amino-2-[[hydroxy(4-phenylbutyl)phosphinyl]oxy]-1-oxohexyl]-L -proline a novel orally active inhibitor of ACE.

description: Small molecule binding data for protein Angiotensin-converting enzyme, Uniprot P12822
DOI: 10.7270/q2th8nsf
title: BindingDB Entry 50040193: Biologically active ester derivatives as potent inhibitors of the soluble epoxide hydrolase.

description: Small molecule binding data for protein Epoxide hydratase, Uniprot P34913
DOI: 10.7270/q2vq33x3
title: BindingDB Entry 50041901: Cytochrome p450 enzymes mechanism based inhibitors: common sub-structures and reactivity.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 1A1, Cytochrome P450 1A2, Cytochrome P450 2A6, Cytochrome P450 2B1, Cytochrome P450 2B11, Cytochrome P450 2B4, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 2E1, Cytochrome P450 3A, Cytochrome P450 3A5 (CYP3A5), and Cytochrome P450 3A6, Uniprot P00176, P00178, P00185, P04798, P04799, P05177, P05181, P05182, P08684, P10632, P10635, P11509, P11707, P11712, P20813, P20815, P24460, and P33261
DOI: 10.7270/q2w0972w
title: BindingDB Entry 50040657: Discovery of 3-(5-chloro-2-furoyl)-3,7-diazabicyclo[3.3.0]octane (TC-6683, AZD1446), a novel highly selectivea4ß2 nicotinic acetylcholine receptor agonist for the treatment of cognitive disorders.

description: Small molecule binding data for protein Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Neuronal acetylcholine receptor protein alpha-7 subunit, and Serotonin 3 (5-HT3) receptor, Uniprot P17787, P36544, P43681, and P46098
DOI: 10.7270/q2x92cpc
title: BindingDB Entry 50042934: Structural, kinetic, and pharmacodynamic mechanisms of D-amino acid oxidase inhibition by small molecules.

description: Small molecule binding data for protein D-Amino Acid Oxidase (DAAO), Uniprot P00371 and P14920
DOI: 10.7270/q2xw4m38
title: BindingDB Entry 50042423: Optimization of highly selective 2,4-diaminopyrimidine-5-carboxamide inhibitors of Sky kinase.

description: Small molecule binding data for protein AKT/p21CIP1, CDK2/Cyclin A/Cyclin A1, CDK6/G1/S-specific cyclin D3, CaM kinase I alpha, Casein kinase I isoform delta, Dual specificty protein kinase CLK1, Ephrin receptor, Epidermal growth factor receptor, Fibroblast growth factor receptor 1, Glycogen synthase kinase-3, IKK epsilon/TBK1, Inhibitor of NF-kappa-B kinase (IKK), Insulin receptor, JAK3/JAK1, MAP kinase ERK2, MAP kinase-activated protein kinase 2, Mitogen-activated protein kinase kinase kinase 9 (MLK1), Mitogen-activated protein kinase kinase kinase kinase 4, P-selectin/P-selectin glycoprotein ligand 1, SRC, Serine/threonine-protein kinase Aurora, Serine/threonine-protein kinase CHK2, Serine/threonine-protein kinase Chk1, Serine/threonine-protein kinase MARK1, Serine/threonine-protein kinase MST2, Serine/threonine-protein kinase MST4, Serine/threonine-protein kinase Nek2, Serine/threonine-protein kinase PAK 4, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase BTK, Tyrosine-protein kinase receptor TYRO3, and myosin light chain kinase 2, Uniprot O14757, O14920, O14965, O95819, O96013, O96017, P00519, P00533, P06213, P06239, P11362, P16109, P20248, P24941, P28482, P29317, P30281, P31749, P48730, P49137, P49759, P49841, P51955, P52333, P78396, P80192, Q00534, Q06187, Q06418, Q13188, Q14012, Q14164, Q9H1R3, Q9P0L2, and Q9P289
DOI: 10.7270/q2z89dh5
title: BindingDB Entry 50040192: Structure-based design of 7-azaindole-pyrrolidine amides as inhibitors of 11ß-hydroxysteroid dehydrogenase type I.

description: Small molecule binding data for protein 11-beta-hydroxysteroid dehydrogenase 1 and 11-beta-hydroxysteroid dehydrogenase 2, Uniprot P28845, P50172, and P80365
DOI: 10.7270/q2125v19
title: BindingDB Entry 50042941: Structure-based design and optimization of 2-aminothiazole-4-carboxamide as a new class of CHK1 inhibitors.

description: Small molecule binding data for protein AKT/p21CIP1, CaM kinase IV, Casein kinase I isoform delta, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Hepatocyte growth factor receptor, Inhibitor of NF-kappa-B kinase (IKK), Insulin-like growth factor I receptor, Interleukin-1 receptor-associated kinase 4, MAP kinase ERK2, Rho-associated protein kinase, Ribosomal protein S6 kinase alpha 3, Serine/threonine-protein kinase Chk1, Serine/threonine-protein kinase MST2, Serine/threonine-protein kinase Nek2, Serine/threonine-protein kinase PLK3, Testis-specific serine/threonine-protein kinase 2, and Tyrosine-protein kinase JAK2, Uniprot O14757, O14920, O60674, O75116, P08069, P08581, P10635, P11712, P28482, P31749, P48730, P51812, P51955, Q13188, Q16566, Q96PF2, Q9H4B4, and Q9NWZ3
DOI: 10.7270/q2154j7x
title: BindingDB Entry 50041160: Analogues of aminoglutethimide based on 1-phenyl-3-azabicyclo[3.1.0]hexane-2,4-dione: selective inhibition of aromatase activity.

description: Small molecule binding data for protein Aromatase (CYP19) and Cytochrome P450 11A1, Uniprot P00189 and P11511
DOI: 10.7270/q23j3f2g
title: BindingDB Entry 50040663: Modulation of DNA repair by pharmacological inhibitors of the PIKK protein kinase family.

description: Small molecule binding data for protein DNA-dependent protein kinase, DNA-dependent protein kinase (DNAPK), HSP90 and hnRNPA2/B1, Serine-protein kinase ATM, and Serine/threonine-protein kinase ATR, Uniprot P08238, P78527, P97313, Q13315, and Q13535
DOI: 10.7270/q24t6kqv
title: BindingDB Entry 50042940: A thiocarbamate inhibitor of endothelial lipase raises HDL cholesterol levels in mice.

description: Small molecule binding data for protein Endothelial lipase (EL), Hepatic Lipase (HL), and Lipoprotein lipase, Uniprot P06858, P11150, Q9WVG5, and Q9Y5X9
DOI: 10.7270/q25d8t42
title: BindingDB Entry 50042429: Sulfated pentagalloylglucoside is a potent, allosteric, and selective inhibitor of factor XIa.

description: Small molecule binding data for protein Coagulation factor XI, Uniprot P03951
DOI: 10.7270/q25t3mkn
title: BindingDB Entry 50040198: Identification of (R)-N-(4-(4-methoxyphenyl)thiazol-2-yl)-1-tosylpiperidine-2-carboxamide, ML277, as a novel, potent and selective K(v)7.1 (KCNQ1) potassium channel activator.

description: Small molecule binding data for protein KCNQ (Kv7) potassium channel and Voltage-gated potassium channel, Uniprot O43526, P51787, P56696, and Q12809
DOI: 10.7270/q27082pm
title: BindingDB Entry 50041906: Pharmacokinetic optimisation of novel indole-2-carboxamide cannabinoid CB1 antagonists.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q27945ss
title: BindingDB Entry 50040662: Discovery of a novel noniminosugar acida glucosidase chaperone series.

description: Small molecule binding data for protein Lysosomal alpha-glucosidase, Uniprot P10253
DOI: 10.7270/q2959jvc
title: BindingDB Entry 50042428: Fragment-based design, synthesis, and biological evaluation of N-substituted-5-(4-isopropylthiophenol)-2-hydroxynicotinamide derivatives as novel Mcl-1 inhibitors.

description: Small molecule binding data for protein Apoptosis regulator Bcl-2 and Induced myeloid leukemia cell differentiation protein Mcl-1, Uniprot P10415 and Q07820