cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2d79crk
title: BindingDB Entry 50042373: Histone deacetylase (HDAC) inhibitors with a novel connecting unit linker region reveal a selectivity profile for HDAC4 and HDAC5 with improved activity against chemoresistant cancer cells.

description: Small molecule binding data for protein Histone deacetylase, Histone deacetylase 1, Histone deacetylase 1/3/5/8, Histone deacetylase 11, Histone deacetylase 4, and Histone deacetylase 8, Uniprot A0A024QZ26, P56524, Q13547, Q92769, Q96DB2, Q9BY41, Q9UBN7, and Q9UQL6
DOI: 10.7270/q2dv1m51
title: BindingDB Entry 50041856: Search for influence of spatial properties on affinity ata1-adrenoceptor subtypes for phenylpiperazine derivatives of phenytoin.

description: Small molecule binding data for protein Adrenergic alpha1B, Alpha-1A adrenergic receptor, and Alpha-1D adrenergic receptor, Uniprot P23944, P35368, and P43140
DOI: 10.7270/q2gh9k4c
title: BindingDB Entry 50041110: Beta 1-selective adrenoceptor antagonists: examples of the 2-[4-[3-(substituted-amino)-2-hydroxypropoxy]phenyl]imidazole class.

description: Small molecule binding data for protein Beta-1 adrenergic receptor and Beta-2 adrenergic receptor, Uniprot Q8K4Z4
DOI: 10.7270/q2jm2bwb
title: BindingDB Entry 50041855: Discovery and structure-activity relationship of a novel spirocarbamate series of NPY Y5 antagonists.

description: Small molecule binding data for protein Neuropeptide Y receptor type 5 ( NPY Y5), Uniprot Q15761
DOI: 10.7270/q2kw5h56
title: BindingDB Entry 50040605: Noncyclam tetraamines inhibit CXC chemokine receptor type 4 and target glioma-initiating cells.

description: Small molecule binding data for protein C-X-C chemokine receptor type 4 (CXCR4) and Voltage-gated potassium channel, Uniprot P61073 and Q12809
DOI: 10.7270/q2m61mbk
title: BindingDB Entry 50040155: Geranylphenazinediol, an acetylcholinesterase inhibitor produced by a Streptomyces species.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P22303
DOI: 10.7270/q2m909v7
title: BindingDB Entry 50041109: alpha-adrenoreceptor reagents. 1. Synthesis of some 1,4-benzodioxans as selective presynaptic alpha 2-adrenoreceptor antagonists and potential antidepressants.

description: Small molecule binding data for protein Adenosine receptor A2b, Uniprot P29276
DOI: 10.7270/q2pc33m2
title: BindingDB Entry 50041854: Synthesis and biochemical characterization of a series of 17a-perfluoroalkylated estradiols as selective ligands for estrogen receptora.

description: Small molecule binding data for protein Estradiol receptor alpha (ERα), Estradiol receptor beta (ERβ), Glucocorticoid receptor, and Mineralocorticoid receptor (MR), Uniprot P03372, P04150, P08235, and Q92731
DOI: 10.7270/q2pz5b66
title: BindingDB Entry 50042897: Synthesis and evaluation of 3-(benzylthio)-5-(1H-indol-3-yl)-1,2,4-triazol-4-amines as Bcl-2 inhibitory anticancer agents.

description: Small molecule binding data for protein Apoptosis regulator Bcl-2, Uniprot P10415
DOI: 10.7270/q2qn67xz
title: BindingDB Entry 50040604: Identification, synthesis, and biological evaluation of 6-[(6R)-2-(4-fluorophenyl)-6-(hydroxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]-2-(2-methylphenyl)pyridazin-3(2H)-one (AS1940477), a potent p38 MAP kinase inhibitor.

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, Mitogen-activated protein kinase 13 (MAPK13), Mitogen-activated protein kinase 9, and Voltage-gated potassium channel, Uniprot O15264, P05177, P08684, P10635, P11712, P33261, P45984, Q12809, and Q15759
DOI: 10.7270/q2qz2c1j
title: BindingDB Entry 50040154: Saquayamycins G-K, cytotoxic angucyclines from Streptomyces sp. Including two analogues bearing the aminosugar rednose.

description: Small molecule binding data for protein Nitric oxide synthase, inducible, Uniprot P35228
DOI: 10.7270/q2r212kz
title: BindingDB Entry 50041108: Conformational requirements for histamine H2-receptor inhibitors: a structure-activity study of phenylene analogues related to cimetidine and tiotidine.

description: Small molecule binding data for protein Histamine H2 receptor, Uniprot P47747
DOI: 10.7270/q2sj1mx6
title: BindingDB Entry 50042370: Design, synthesis and molecular docking ofa,ß-unsaturated cyclohexanone analogous of curcumin as potent EGFR inhibitors with antiproliferative activity.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q2t154x2
title: BindingDB Entry 50041853: Rigid analogues of thea2-adrenergic blocker atipamezole: small changes, big consequences.

description: Small molecule binding data for protein Adrenergic alpha1B, Alpha-2A adrenergic receptor, Alpha-2B adrenergic receptor, and Alpha-2C adrenergic receptor, Uniprot P08913, P18089, P18825, P35368, and Q4W594
DOI: 10.7270/q2tq62xh
title: BindingDB Entry 50042896: Novel 5-(benzyloxy)pyridin-2(1H)-one derivatives as potent c-Met inhibitors.

description: Small molecule binding data for protein Hepatocyte growth factor receptor, Kinesin-1 heavy chain/ Tyrosine-protein kinase receptor RET, Macrophage-stimulating protein receptor, Platelet-derived growth factor receptor, Tyrosine-protein kinase ABL1, and Tyrosine-protein kinase receptor TYRO3, Uniprot P00519, P07949, P08581, P16234, Q04912, and Q06418
DOI: 10.7270/q2vd70ks
title: BindingDB Entry 50040603: A novel aminopeptidase N inhibitor developed by virtual screening approach.

description: Small molecule binding data for protein Aminopeptidase N, Uniprot P15145
DOI: 10.7270/q2vm4dbj
title: BindingDB Entry 50040153: Antidiabetic compounds from Sarracenia purpurea used traditionally by the Eeyou Istchee Cree First Nation.

description: Small molecule binding data for protein Glucose-6-phosphatase, Uniprot P43428
DOI: 10.7270/q2x63p82
title: BindingDB Entry 50042369: Exploring amino acids derivatives as potent, selective, and direct agonists of sphingosine-1-phosphate receptor subtype-1.

description: Small molecule binding data for protein Sphingosine 1-phosphate receptor and Sphingosine 1-phosphate receptor 3, Uniprot P21453 and Q99500
DOI: 10.7270/q2xs5wn3
title: BindingDB Entry 50041852: 3D-QSAR CoMFA study of benzoxazepine derivatives as mGluR5 positive allosteric modulators.

description: Small molecule binding data for protein Metabotropic glutamate receptor, Uniprot P31424
DOI: 10.7270/q20z74mn
title: BindingDB Entry 50042376: The discovery of fused oxadiazepines as gamma secretase modulators for treatment of Alzheimer's disease.

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/q21j9c1v
title: BindingDB Entry 50041859: Surface plasmon resonance biosensor based fragment screening using acetylcholine binding protein identifies ligand efficiency hot spots (LE hot spots) by deconstruction of nicotinic acetylcholine receptora7 ligands.

description: Small molecule binding data for protein Acetylcholine Binding protein and Neuronal acetylcholine receptor protein alpha-7 subunit, Uniprot P36544 and P58154
DOI: 10.7270/q22v2h8d
title: BindingDB Entry 50040609: Structural sweet spot for A1 adenosine receptor activation by truncated (N)-methanocarba nucleosides: receptor docking and potent anticonvulsant activity.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, and Adenosine receptor A3, Uniprot P0DMS8, P29274, and P30542
DOI: 10.7270/q23779w0
title: BindingDB Entry 50041113: Synthesis and beta-adrenergic blocking activity of new aliphatic and alicyclic oxime ethers.

description: Small molecule binding data for protein Beta-1 adrenergic receptor and Beta-2 adrenergic receptor, Uniprot Q8K4Z4
DOI: 10.7270/q24q7w9j
title: BindingDB Entry 50042375: Development of new cathepsin B inhibitors: combining bioisosteric replacements and structure-based design to explore the structure-activity relationships of nitroxoline derivatives.

description: Small molecule binding data for protein Cathepsin (B and K), Cathepsin (H and K), and Cathepsin L1, Uniprot P07711, P07858, and P09668
DOI: 10.7270/q25b03rq
title: BindingDB Entry 50041858: Chemistry and pharmacological characterization of novel nitrogen analogues of AMOP-H-OH (Sazetidine-A, 6-[5-(azetidin-2-ylmethoxy)pyridin-3-yl]hex-5-yn-1-ol) asa4ß2-nicotinic acetylcholine receptor-selective partial agonists.

description: Small molecule binding data for protein Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Uniprot P17787 and P43681
DOI: 10.7270/q26m37z8
title: BindingDB Entry 50040608: An aromatic region to induce a switch between agonism and inverse agonism at the ghrelin receptor.

description: Small molecule binding data for protein Ghrelin receptor, Uniprot Q92847
DOI: 10.7270/q26w9c46
title: BindingDB Entry 50040158: New hypotheses for the binding mode of 4- and 7-substituted indazoles in the active site of neuronal nitric oxide synthase.

description: Small molecule binding data for protein Nitric-oxide synthase, brain, Uniprot P29476
DOI: 10.7270/q27082k8
title: BindingDB Entry 50041112: Inhibitors of glycolic acid oxidase. 4-substituted 2,4-dioxobutanoic acid derivatives.

description: Small molecule binding data for protein Hydroxyacid oxidase 1, Uniprot Q9UJM8
DOI: 10.7270/q28g8n18
title: BindingDB Entry 50042374: Comparative structural and functional studies of 4-(thiazol-5-yl)-2-(phenylamino)pyrimidine-5-carbonitrile CDK9 inhibitors suggest the basis for isotype selectivity.

description: Small molecule binding data for protein CDK2/Cyclin A/Cyclin A1, Cyclin-Dependent Kinase 9 (CDK9), Cyclin-dependent kinase 1, Cyclin-dependent kinase 2, Cyclin-dependent kinase 4, and Cyclin-dependent kinase 9, Uniprot O60563, P06493, P11802, P20248, P24941, P50750, and P78396
DOI: 10.7270/q2930vfm
title: BindingDB Entry 50041857: A novel series of positive modulators of the AMPA receptor: structure-based lead optimization.

description: Small molecule binding data for protein Metabotropic glutamate receptor 1, Uniprot Q13255
DOI: 10.7270/q29p3314
title: BindingDB Entry 50042900: N-(Pyridin-2-yl) arylsulfonamide inhibitors of 11ß-hydroxysteroid dehydrogenase type 1: strategies to eliminate reactive metabolites.

description: Small molecule binding data for protein 11-beta-hydroxysteroid dehydrogenase 1, Uniprot P28845
DOI: 10.7270/q2bc40nj
title: BindingDB Entry 50040607: Design and synthesis of indomethacin analogues that inhibit P-glycoprotein and/or multidrug resistant protein without COX inhibitory activity.

description: Small molecule binding data for protein Prostaglandin G/H synthase (Cyclooxygenase-2) and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P79208
DOI: 10.7270/q2bp03v2
title: BindingDB Entry 50040157: Virtual screening leads to the discovery of novel non-nucleotide P2Y1 receptor antagonists.

description: Small molecule binding data for protein Purinergic receptor P2Y1, Uniprot P47900
DOI: 10.7270/q2ff3tqm
title: BindingDB Entry 50042899: Disulfide linked pyrazole derivatives inhibit phagocytosis of opsonized blood cells.

description: Small molecule binding data for protein High affinity immunoglobulin gamma Fc receptor I, Uniprot P12314
DOI: 10.7270/q2g44rdb
title: BindingDB Entry 50040606: Pd-catalyzed direct C-H bond functionalization of spirocyclics1 ligands: generation of a pharmacophore model and analysis of the reverse binding mode by docking into a 3D homology model of thes1 receptor.

description: Small molecule binding data for protein Sigma-1 receptor, Uniprot Q60492
DOI: 10.7270/q2gf0vkd
title: BindingDB Entry 50040156: Identification of new¿-hydroxybutenolides that preferentially inhibit the activity of mPGES-1.

description: Small molecule binding data for protein Prostaglandin E synthase, Uniprot O14684
DOI: 10.7270/q2j104h9
title: BindingDB Entry 50042372: MMP inhibition by barbiturate homodimers.

description: Small molecule binding data for protein Collagenase and Matrix Metalloproteinase-8 (MMP-8), Uniprot P08253, P14780, P22894, and P45452
DOI: 10.7270/q2k64kfb
title: BindingDB Entry 50042898: Biaryl tetrazolyl ureas as inhibitors of endocannabinoid metabolism: modulation at the N-portion and distal phenyl ring.

description: Small molecule binding data for protein Anandamide amidohydrolase, Monoglyceride Lipase (MGL), Transient receptor potential cation channel subfamily A member 1, and Transient receptor potential cation channel subfamily V member 1, Uniprot O75762, P97612, Q6RI86, Q8NER1, and Q99685
DOI: 10.7270/q2nc62gp
title: BindingDB Entry 50041862: Identification of 2-oxo-N-(phenylmethyl)-4-imidazolidinecarboxamide antagonists of the P2X(7) receptor.

description: Small molecule binding data for protein P2X purinoceptor 7 and P2X purinoceptor 7 (P2X7), Uniprot Q64663 and Q99572
DOI: 10.7270/q2ns0w7b
title: BindingDB Entry 50042371: Synthesis, molecular docking and evaluation of thiazolyl-pyrazoline derivatives containing benzodioxole as potential anticancer agents.

description: Small molecule binding data for protein Epidermal growth factor receptor and ErbB2 (HER1 and HER2), Uniprot P04626
DOI: 10.7270/q2q241fk
title: BindingDB Entry 50041116: Quantitative structure-activity relationships of 6-anilinouracils as inhibitors of Bacillus subtilis DNA polymerase III.

description: Small molecule binding data for protein DNA topoisomerase III, Uniprot P96583
DOI: 10.7270/q2s46t61
title: BindingDB Entry 50041861: Synthesis and evaluation of bivalent, peptidomimetic antagonists of theavß3 integrins.

description: Small molecule binding data for protein Integrin beta-3/Vitronectin receptor alpha, Uniprot P05106 and P06756
DOI: 10.7270/q2tt4s5m
title: BindingDB Entry 50041115: Crystallography, quantitative structure-activity relationships, and molecular graphics in a comparative analysis of the inhibition of dihydrofolate reductase from chicken liver and Lactobacillus casei by 4,6-diamino-1,2-dihydro-2,2-dimethyl-1-(substituted-phenyl)-s-triazine s.

description: Small molecule binding data for protein Dihydrofolate reductase, Uniprot P00378 and P00381
DOI: 10.7270/q2ws8vhq
title: BindingDB Entry 50041860: Design, synthesis and structure-activity relationship of novel quinoxalin-2-carboxamides as 5-HT3 receptor antagonists for the management of depression.

description: Small molecule binding data for protein HTR3A, Uniprot O70212
DOI: 10.7270/q2z60q59
title: BindingDB Entry 50040610: Discovery of a novel class of exquisitely selective mesenchymal-epithelial transition factor (c-MET) protein kinase inhibitors and identification of the clinical candidate 2-(4-(1-(quinolin-6-ylmethyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-6-yl)-1H-pyrazol-1-yl)ethanol (PF-04217903) for the treatment of

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Hepatocyte growth factor receptor, and Voltage-gated potassium channel, Uniprot P05177, P08581, P08684, P10632, P10635, P11712, P33261, and Q12809
DOI: 10.7270/q2zg6tmd
title: BindingDB Entry 50042895: BCR-ABL tyrosine kinase inhibitor pharmacophore model derived from a series of phenylaminopyrimidine-based (PAP) derivatives.

description: Small molecule binding data for protein Breakpoint cluster region protein /Tyrosine-protein kinase ABL, Uniprot P00519 and P11274
DOI: 10.7270/q228090q
title: BindingDB Entry 50042902: New potent calcimimetics: II. Discovery of benzothiazole trisubstituted ureas.

description: Small molecule binding data for protein Calcium-sensing receptor (CaSR), Uniprot P41180
DOI: 10.7270/q22b906s
title: BindingDB Entry 50041121: The 3,4-catechol derivative of propranolol, a minor dihydroxylated metabolite.

description: Small molecule binding data for protein Beta-1 adrenergic receptor and Beta-2 adrenergic receptor, Uniprot P54833
DOI: 10.7270/q2348mf7
title: BindingDB Entry 50040159: N-Aryl pyrrolidinonyl oxadiazoles as potent mGluR5 positive allosteric modulators.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Metabotropic glutamate receptor 5, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P33261, P41594, and Q12809
DOI: 10.7270/q24b32jf
title: BindingDB Entry 50041866: Fruitful adrenergica(2C)-agonism/a(2A)-antagonism combination to prevent and contrast morphine tolerance and dependence.

description: Small molecule binding data for protein Alpha-2A adrenergic receptor, Alpha-2B adrenergic receptor, and Alpha-2C adrenergic receptor, Uniprot P08913, P18089, P18825, and Q4W594
DOI: 10.7270/q25m66vb
title: BindingDB Entry 50040616: Exploration of novel 3-substituted azetidine derivatives as triple reuptake inhibitors.

description: Small molecule binding data for protein Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, Sodium-dependent noradrenaline transporter, and Voltage-gated potassium channel, Uniprot P23975, P31645, Q01959, and Q12809
DOI: 10.7270/q26111hb
title: BindingDB Entry 50041120: Aporphines. 58. N-(2-chloroethyl) [8,9-2H]norapomorphine, an irreversible ligand for dopamine receptors: synthesis and application.

description: Small molecule binding data for protein DRD1, Uniprot Q9GJU1
DOI: 10.7270/q26111pk
title: BindingDB Entry 50042901: Identification of pyrrolo[2,3-g]indazoles as new Pim kinase inhibitors.

description: Small molecule binding data for protein Serine/threonine-protein kinase PIM, Uniprot P11309 and Q86V86
DOI: 10.7270/q27h1kw1
title: BindingDB Entry 50042382: Identification of benzofuran central cores for the inhibition of leukotriene A(4) hydrolase.

description: Small molecule binding data for protein Leukotriene A4 hydrolase, Uniprot P09960 and P24527
DOI: 10.7270/q2833t8s
title: BindingDB Entry 50041865: QSAR prediction of D2 receptor antagonistic activity of 6-methoxy benzamides.

description: Small molecule binding data for protein Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416
DOI: 10.7270/q29s1s6x
title: BindingDB Entry 50041119: Inhibition of arabinose 5-phosphate isomerase. An approach to the inhibition of bacterial lipopolysaccharide biosynthesis.

description: Small molecule binding data for protein Arabinose 5-phosphate isomerase, Uniprot Q8ZLS1
DOI: 10.7270/q2c82bmr
title: BindingDB Entry 50042381: Discovery of a new series of [1,2,4]triazolo[4,3-a]quinoxalines as dual phosphodiesterase 2/phosphodiesterase 10 (PDE2/PDE10) inhibitors.

description: Small molecule binding data for protein Phosphodiesterase 1, Phosphodiesterase 11A (PDE11A), Phosphodiesterase 3 (PDE3), Phosphodiesterase 7, Phosphodiesterase 9A, Phosphodiesterase Type 10 (PDE10A), cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4A, cGMP-dependent 3',5'-cyclic phosphodiesterase, cGMP-inhibited 3',5'-cyclic phosphodiesterase B, and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O00408, O76074, O76083, P27815, Q01064, Q13370, Q13946, Q14432, Q9HCR9, Q9QYJ6, and Q9Y233
DOI: 10.7270/q2cv4k06
title: BindingDB Entry 50041864: Computational analysis of ligand recognition sites of homo- and heteropentameric 5-HT3 receptors.

description: Small molecule binding data for protein Serotonin 3 (5-HT3) receptor, Uniprot P46098
DOI: 10.7270/q2f47q7h
title: BindingDB Entry 50040614: Design of a hypoxia-activated prodrug inhibitor of O6-alkylguanine-DNA alkyltransferase.

description: Small molecule binding data for protein 6-O-methylguanine-DNA methyltransferase, Uniprot P16455
DOI: 10.7270/q2fj2hzp
title: BindingDB Entry 50041118: Inhibitors of inosinic acid dehydrogenase. 2-Substituted inosinic acids.

description: Small molecule binding data for protein Inosine-5'-monophosphate dehydrogenase, Uniprot P0ADG7
DOI: 10.7270/q2h133bg
title: BindingDB Entry 50042380: Synthesis and evaluation of diphenylphosphinic amides and diphenylphosphine oxides as inhibitors of Kv1.5.

description: Small molecule binding data for protein Intermediate conductance calcium-activated potassium channel protein 4, Voltage-gated potassium channel, and Voltage-gated potassium channel subunit Kv1.5, Uniprot O15554, P22460, and Q12809
DOI: 10.7270/q2hm59qh
title: BindingDB Entry 50041863: Synthesis and molecular modelling studies of prenylated pyrazolines as MAO-B inhibitors.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A and Amine oxidase [flavin-containing] B, Uniprot P21397 and P27338
DOI: 10.7270/q2j67j8h
title: BindingDB Entry 50042906: Novel indoline-2,3-dione derivatives as inhibitors of aminopeptidase N (APN).

description: Small molecule binding data for protein Aminopeptidase N, Uniprot P15144 and P15145
DOI: 10.7270/q2jw8g0c
title: BindingDB Entry 50040613: Benzodeazaoxaflavins as sirtuin inhibitors with antiproliferative properties in cancer stem cells.

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/q2k938qv
title: BindingDB Entry 50041117: Design and synthesis of tetrahedral intermediate analogues as potential dihydroorotase inhibitors.

description: Small molecule binding data for protein Dihydroorotase, Uniprot B2RQC6
DOI: 10.7270/q2ms3v3z
title: BindingDB Entry 50042379: Synthesis and biological evaluation of indenoisoquinolines that inhibit both tyrosyl-DNA phosphodiesterase I (Tdp1) and topoisomerase I (Top1).

description: Small molecule binding data for protein Tyrosyl-DNA phosphodiesterase 1 (TDP1), Uniprot Q9NUW8
DOI: 10.7270/q2nz890x
title: BindingDB Entry 50042905: Structure-based design, SAR analysis and antitumor activity of PI3K/mTOR dual inhibitors from 4-methylpyridopyrimidinone series.

description: Small molecule binding data for protein AKT/p21CIP1, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (PI3K alpha), and Serine/threonine-protein kinase mTOR, Uniprot P31749, P42337, and P42345
DOI: 10.7270/q2pn96r4
title: BindingDB Entry 50040612: Pharmacophore-based virtual screening and biological evaluation of small molecule inhibitors for protein arginine methylation.

description: Small molecule binding data for protein Histone H4, Histone acetyltransferase p300, and Protein-arginine N-methyltransferase 1, Uniprot P62805 and Q09472
DOI: 10.7270/q2pz59wr
title: BindingDB Entry 50040162: Discovery and biological evaluation of novel 4-amino-2-phenylpyrimidine derivatives as potent and orally active GPR119 agonists.

description: Small molecule binding data for protein Cytochrome P450 1A, Uniprot P05177
DOI: 10.7270/q2rj4kst
title: BindingDB Entry 50042378: Synthesis, pharmacology, and biostructural characterization of novela4ß2 nicotinic acetylcholine receptor agonists.

description: Small molecule binding data for protein Acetylcholine Binding protein, Neuronal acetylcholine receptor, and Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Uniprot P17787, P43681, P58154, and Q05941
DOI: 10.7270/q2td9zgg
title: BindingDB Entry 50040611: Synthesis and structure-activity relationship investigation of adenosine-containing inhibitors of histone methyltransferase DOT1L.

description: Small molecule binding data for protein Histone H3-K79 methyltransferase (DOT1L), Histone-arginine methyltransferase CARM1, Histone-lysine N-methyltransferase SUV39H1, and Protein-arginine N-methyltransferase 1, Uniprot O43463, Q86X55, and Q8TEK3
DOI: 10.7270/q2tq62k1
title: BindingDB Entry 50040161: Synthesis and biological evaluation of novel oxindole derivatives for imaging neurofibrillary tangles in Alzheimer's disease.

description: Small molecule binding data for protein Tau, Uniprot P10636
DOI: 10.7270/q2w95bg3
title: BindingDB Entry 50042377: Structural-functional studies of Burkholderia cenocepacia D-glycero-ß-D-manno-heptose 7-phosphate kinase (HldA) and characterization of inhibitors with antibiotic adjuvant and antivirulence properties.

description: Small molecule binding data for protein D-beta-D-heptose 7-phosphate kinase