cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q25t3n47
title: BindingDB Entry 50045080: From chemical tools to clinical medicines: nonimmunosuppressive cyclophilin inhibitors derived from the cyclosporin and sanglifehrin scaffolds.

description: Small molecule binding data for protein Cyclophilin A and Peptidyl-prolyl cis-trans isomerase F, mitochondrial, Uniprot P30405 and P62937
DOI: 10.7270/q26d5vd7
title: BindingDB Entry 50043404: Design, synthesis, and biological and crystallographic evaluation of novel inhibitors of Plasmodium falciparum enoyl-ACP-reductase (PfFabI).

description: Small molecule binding data for protein 3-oxoacyl-(Acyl-carrier protein) reductase and Fatty acid synthase
DOI: 10.7270/q280544f
title: BindingDB Entry 50044048: TBA

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor and Peroxisome proliferator-activated receptor alpha (PPAR alpha), Uniprot P37231 and Q07869
DOI: 10.7270/q28c9xss
title: BindingDB Entry 50044553: Discovery and structure-activity relationship of novel 2,3-dihydrobenzofuran-7-carboxamide and 2,3-dihydrobenzofuran-3(2H)-one-7-carboxamide derivatives as poly(ADP-ribose)polymerase-1 inhibitors.

description: Small molecule binding data for protein poly-ADP-ribose polymerase 1 (PARP1), Uniprot P09874
DOI: 10.7270/q29888pg
title: BindingDB Entry 50045530: Structure-activity relationships of substituted 1H-indole-2-carboxamides as CB1 receptor allosteric modulators.

description: Small molecule binding data for protein Cannabinoid receptor 1, Uniprot P21554
DOI: 10.7270/q29k4cw0
title: BindingDB Entry 50045079: Biased and unbiased strategies to identify biologically active small molecules.

description: Small molecule binding data for protein AKT/p21CIP1, Acetylcholinesterase, Apoptosis regulator Bcl-B (Bcl-2-like 10 protein) (Bcl2-L-10) (Anti-apoptotic protein NrH)., Casein Kinase II, Cyclin-dependent kinase 1, Farnesyl diphosphate synthase, Glutathione S-transferase Mu 1, Induced myeloid leukemia cell differentiation protein Mcl-1, and Serine/threonine-protein kinase Aurora, Uniprot O14965, P02666, P06493, P10649, P14324, P22303, P31749, Q07820, and Q9HD36
DOI: 10.7270/q2cf9rv7
title: BindingDB Entry 50046048: Natural Product Primary Sulfonamides and Primary Sulfamates.

description: Small molecule binding data for protein Histone deacetylase, Uniprot A0A024QZ26, O15379, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2d2206g
title: BindingDB Entry 50044552: Tricyclic pyrazoles. Part 6. Benzofuro[3,2-c]pyrazole: a versatile architecture for CB2 selective ligands.

description: Small molecule binding data for protein Cannabinoid receptor, Cannabinoid receptor 1, Cannabinoid receptor 1 (CB1R), and Cannabinoid receptor 2, Uniprot P21554, P34972, P47746, and P47936
DOI: 10.7270/q2f191d6
title: BindingDB Entry 50045529: A combination of in silico and SAR studies to identify binding hot spots of Bcl-xL inhibitors.

description: Small molecule binding data for protein Bcl-xL/BAK, Uniprot Q07817
DOI: 10.7270/q2fb54mq
title: BindingDB Entry 50045078: Discovery of novel 2,4-diarylaminopyrimidine analogues (DAAPalogues) showing potent inhibitory activities against both wild-type and mutant ALK kinases.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, AXL receptor tyrosine kinase, Epidermal growth factor receptor, Hepatocyte growth factor receptor, MER intracellular domain/EGFR extracellular domain chimera, Platelet-derived growth factor receptor, Platelet-derived growth factor receptor beta, Tyrosine-protein kinase ABL1, 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, P00519, P00533, P08581, P09619, P10721, P12931, P16234, P17948, P30530, P35968, Q12866, and Q9UM73
DOI: 10.7270/q2ft8ng3
title: BindingDB Entry 50043402: Structure-kinetic relationships--an overlooked parameter in hit-to-lead optimization: a case of cyclopentylamines as chemokine receptor 2 antagonists.

description: Small molecule binding data for protein C-C motif chemokine 2, Uniprot P13500
DOI: 10.7270/q2ht2qwn
title: BindingDB Entry 50044551: SAR studies on curcumin's pro-inflammatory targets: discovery of prenylated pyrazolocurcuminoids as potent and selective novel inhibitors of 5-lipoxygenase.

description: Small molecule binding data for protein 12-Lipoxygenase (12-LOX), 5-lipoxygenase/FLAP, Arachidonate 15-lipoxygenase, Cyclooxygenase, Cyclooxygenase-1 (COX-1), Nuclear factor erythroid 2-related factor 2, Prostaglandin E synthase, and Signal transducer and activator of transcription 3, Uniprot O14684, P09917, P16050, P18054, P23219, P35354, P40763, and Q16236
DOI: 10.7270/q2k35w9m
title: BindingDB Entry 50045077: Structural basis for isoform selectivity in a class of benzothiazole inhibitors of phosphoinositide 3-kinase¿.

description: Small molecule binding data for protein PI3-kinase subunit alpha and PI3-kinase subunit gamma, Uniprot P42336 and P48736
DOI: 10.7270/q2m61msd
title: BindingDB Entry 50044053: Xanthates and trithiocarbonates strongly inhibit carbonic anhydrases and show antiglaucoma effects in vivo.

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/q2n01897
title: BindingDB Entry 50046046: Selective inhibition of prolyl 4-hydroxylases by bipyridinedicarboxylates.

description: Small molecule binding data for protein Prolyl 4-hydroxylase subunit alpha-1, Uniprot P13674
DOI: 10.7270/q2pv6n0k
title: BindingDB Entry 50045076: Nucleotide-binding oligomerization domain (NOD) inhibitors: a rational approach toward inhibition of NOD signaling pathway.

description: Small molecule binding data for protein Nucleotide-binding oligomerization domain-containing protein 2 and nucleotide-binding oligomerization domain containing 1, Uniprot Q9HC29 and Q9Y239
DOI: 10.7270/q2qz2cgc
title: BindingDB Entry 50044052: Discovery of aryl-biphenyl-2-ylmethylpiperazines as novel scaffolds for 5-HT(7) ligands and role of the aromatic substituents in binding to the target receptor.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 7 (5-HT7), Uniprot P34969
DOI: 10.7270/q2rr211n
title: BindingDB Entry 50046045: Design and synthesis of novel ROR inverse agonists with a dibenzosilole scaffold as a hydrophobic core structure.

description: Small molecule binding data for protein Nuclear receptor ROR-alpha, Nuclear receptor ROR-beta, and Nuclear receptor ROR-gamma, Uniprot P35398, P51449, Q6I9R9, and Q92753
DOI: 10.7270/q2t72k42
title: BindingDB Entry 50045526: Azachalcones: a new class of potent polyphenol oxidase inhibitors.

description: Small molecule binding data for protein Tyrosinase, Uniprot O42713
DOI: 10.7270/q2vq3463
title: BindingDB Entry 50044051: The alpha-carbonic anhydrase from the thermophilic bacterium Sulfurihydrogenibium yellowstonense YO3AOP1 is highly susceptible to inhibition by sulfonamides.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrase 2, Uniprot P00915 and P00918
DOI: 10.7270/q2wh2rrk
title: BindingDB Entry 50046044: New amide derivatives of Probenecid as selective inhibitors of carbonic anhydrase IX and XII: biological evaluation and molecular modelling studies.

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/q2x3504q
title: BindingDB Entry 50045533: Synthesis and optimization of picolinamide derivatives as a novel class of 11ß-hydroxysteroid dehydrogenase type 1 (11ß-HSD1) inhibitors.

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/q208672f
title: BindingDB Entry 50046051: Discovery of mammalian target of rapamycin (mTOR) kinase inhibitor CC-223.

description: Small molecule binding data for protein Focal adhesion kinase 1/vascular endothelial growth factor receptor 3, Macrophage colony stimulating factor receptor, Mammalian target of Rapamycin (mTORC1), PI3-kinase subunit alpha, Serine/threonine-protein kinase mTOR, and Voltage-gated potassium channel, Uniprot P07333, P35916, P42336, P42345, P62942, and Q12809
DOI: 10.7270/q2222wdt
title: BindingDB Entry 50045081: Small molecule inhibitors targeting activator protein 1 (AP-1).

description: Small molecule binding data for protein RXR alpha/PPAR gamma, Retinoid X receptor gamma/retinoic acid receptor alpha, Retinoid receptor, and Transcription factor AP-1, Uniprot P05412, P10276, P10826, P13631, P17325, and P19793
DOI: 10.7270/q22n53qb
title: BindingDB Entry 50043405: TBA

description: Small molecule binding data for protein Arachidonate 5-lipoxygenase, Uniprot P12527
DOI: 10.7270/q2377b7w
title: BindingDB Entry 50044057: TBA

description: Small molecule binding data for protein Prothrombin and Urokinase-type plasminogen activator, Uniprot P00734 and P00749
DOI: 10.7270/q2416zsc
title: BindingDB Entry 50046050: A selective prostaglandin E2 receptor subtype 2 (EP2) antagonist increases the macrophage-mediated clearance of amyloid-beta plaques.

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 EP2 Receptor, Prostanoid EP2 receptor, Prostanoid IP receptor, and Prostanoid TP receptor, Uniprot P21731, P34995, P35408, P43115, P43116, P43119, Q13258, Q62053, Q62928, and Q9Y5Y4
DOI: 10.7270/q27082z6
title: BindingDB Entry 50044056: Nitric oxide donating anilinopyrimidines: synthesis and biological evaluation as EGFR inhibitors.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q27d2wqv
title: BindingDB Entry 50044561: Synthesis and anti-cholinesterase activity of new 7-hydroxycoumarin derivatives.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BuChE), Uniprot O42275 and P81908
DOI: 10.7270/q27p915r
title: BindingDB Entry 50046049: Flavonoids from Perovskia atriplicifolia and Their in Vitro Displacement of the Respective Radioligands for Human Opioid and Cannabinoid Receptors.

description: Small molecule binding data for protein Delta-type opioid receptor, Uniprot P41143
DOI: 10.7270/q2b27wrp
title: BindingDB Entry 50043403: Small-molecule ligands of methyl-lysine binding proteins: optimization of selectivity for L3MBTL3.

description: Small molecule binding data for protein Chromobox protein homolog 7 (CBX7), E3 ubiquitin-protein ligase (UHRF1), Histone demethylase JARID1A, Lethal(3)malignant brain tumor-like protein 1 (L3MBTL1), Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3), Lethal(3)malignant brain tumor-like protein 4, MBT domain-containing protein 1 (MBTD1), PHD finger protein 23 (PHF23), Scm-like with four MBT domains protein 1, and Tumor suppressor p53-binding protein 1, Uniprot O95931, P29375, Q05BQ5, Q12888, Q8NA19, Q96JM7, Q96T88, Q9BUL5, and Q9UHJ3
DOI: 10.7270/q2br8tp7
title: BindingDB Entry 50044055: TBA

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2d2209t
title: BindingDB Entry 50045537: Acyl-2-aminobenzimidazoles: a novel class of neuroprotective agents targeting mGluR5.

description: Small molecule binding data for protein Metabotropic glutamate receptor 5, Uniprot Q3UVX5
DOI: 10.7270/q2db83hs
title: BindingDB Entry 50045086: Synthesis and biological evaluation of substituted 3-anilino-quinolin-2(1H)-ones as PDK1 inhibitors.

description: Small molecule binding data for protein 3-phosphoinositide dependent protein kinase-1, Uniprot O15530
DOI: 10.7270/q2dv1mb8
title: BindingDB Entry 50043410: TBA

description: Small molecule binding data for protein Bromodomain-containing protein 4, Uniprot O60885
DOI: 10.7270/q2gh9kfd
title: BindingDB Entry 50044054: Discovery of new potent inhibitors for carbonic anhydrase IX by structure-based virtual screening.

description: Small molecule binding data for protein Carbonic anhydrase, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot P00915, P00918, and Q16790
DOI: 10.7270/q2gt5pr8
title: BindingDB Entry 50044559: Diphenylpyrroles: Novel p53 activators.

description: Small molecule binding data for protein E3 ubiquitin-protein ligase Mdm2, Uniprot Q00987
DOI: 10.7270/q2h70hkh
title: BindingDB Entry 50046047: In Vitro Inhibitory Effects of 8-O-Demethylmaritidine and Undulatine on Acetylcholinesterase and Their Predicted Penetration across the Blood-Brain Barrier.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275
DOI: 10.7270/q2ht2r1v
title: BindingDB Entry 50045536: Design and synthesis of novel quinoline-aminopiperidine hybrid analogues as Mycobacterium tuberculosis DNA gyraseB inhibitors.

description: Small molecule binding data for protein DNA gyrase subunit B, Uniprot P0C559
DOI: 10.7270/q2j38v74
title: BindingDB Entry 50045085: Discovery of N-substituted 7-azaindoline derivatives as potent, orally available M1 and M4 muscarinic acetylcholine receptors selective agonists.

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M2 and M4, and Voltage-gated potassium channel, Uniprot P08173, P11229, and Q12809
DOI: 10.7270/q2jm2c20
title: BindingDB Entry 50043409: TBA

description: Small molecule binding data for protein Cytochrome P450 2D6 (2D6) and Probable G-protein coupled receptor 142, Uniprot P10635, Q7TQN9, and Q7Z601
DOI: 10.7270/q2mk6ffj
title: BindingDB Entry 50044558: Tyrosinase inhibitory activity of a glucosylated hydroxystilbene in mouse melan-a melanocytes.

description: Small molecule binding data for protein Tyrosinase, Uniprot P11344
DOI: 10.7270/q2nk3gr5
title: BindingDB Entry 50045535: Cell-based biological evaluations of 5-(3-bromo-4-phenethoxybenzylidene)thiazolidine-2,4-dione as promising wound healing agent.

description: Small molecule binding data for protein 15-hydroxyprostaglandin dehydrogenase [NAD+], Uniprot P15428
DOI: 10.7270/q2nv9kw7
title: BindingDB Entry 50045084: Targeting the homologous recombination pathway by small molecule modulators.

description: Small molecule binding data for protein Bloom syndrome protein, Cell cycle checkpoint protein RAD1, DNA repair and recombination protein RAD54-like, Double-strand break repair protein MRE11A, and Werner syndrome ATP-dependent helicase, Uniprot O60671, P49959, P54132, Q14191, and Q92698
DOI: 10.7270/q2rb764t
title: BindingDB Entry 50044557: Synthesis and evaluation of three structurally related¹8F-labeled orvinols of different intrinsic activities: 6-O-[¹8F]fluoroethyl-diprenorphine ([¹8F]FDPN), 6-O-[¹8F]fluoroethyl-buprenorphine ([¹8F]FBPN), and 6-O-[¹8F]fluoroethyl-phenethyl-orvinol ([¹8F]FPEO).

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
DOI: 10.7270/q2sb47ff
title: BindingDB Entry 50045534: Discovery of a potent, orally available dual CysLT1 and CysLT2 antagonist with dicarboxylic acid.

description: Small molecule binding data for protein Cysteinyl leukotriene receptor 1 and Cysteinyl leukotriene receptor 2, Uniprot Q9NS75 and Q9Y271
DOI: 10.7270/q2sn0bk2
title: BindingDB Entry 50045083: trans-Caryophyllene is a natural agonistic ligand for peroxisome proliferator-activated receptor-a.

description: Small molecule binding data for protein Cannabinoid receptor 2 and Peroxisome proliferator-activated receptor alpha (PPAR alpha), Uniprot P34972 and Q07869
DOI: 10.7270/q2t43vj3
title: BindingDB Entry 50043407: TBA

description: Small molecule binding data for protein Protein-Tyrosine Phosphatase 1B (PTP1B), Uniprot P20417
DOI: 10.7270/q2vh5qm6
title: BindingDB Entry 50046052: Structures and Biological Evaluations of Agelasines Isolated from the Okinawan Marine Sponge Agelas nakamurai.

description: Small molecule binding data for protein Protein-tyrosine phosphatase 1B, Uniprot P18031
DOI: 10.7270/q2w37xvr
title: BindingDB Entry 50044556: Design, synthesis and biological evaluation of hybrid bioisoster derivatives of N-acylhydrazone and furoxan groups with potential and selective anti-Trypanosoma cruzi activity.

description: Small molecule binding data for protein Cruzipain, Uniprot P25779
DOI: 10.7270/q2x92czz
title: BindingDB Entry 50045082: Serotonin 5-HT6 receptor antagonists for the treatment of cognitive deficiency in Alzheimer's disease.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6), Uniprot P50406
DOI: 10.7270/q2xw4m8h
title: BindingDB Entry 50043406: TBA

description: Small molecule binding data for protein Focal adhesion kinase 1/vascular endothelial growth factor receptor 3 and PTK2B protein tyrosine kinase 2 beta (PTK2B), Uniprot Q05397 and Q14289
DOI: 10.7270/q2zg6tr6
title: BindingDB Entry 50044058: Preparation, in vitro evaluation and molecular modelling of pyridinium-quinolinium/isoquinolinium non-symmetrical bisquaternary cholinesterase inhibitors.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P06276 and P22303
DOI: 10.7270/q20v8ffg
title: BindingDB Entry 50045540: New septanoside and 20-hydroxyecdysone septanoside derivative from Atriplex portulacoides roots with preliminary biological activities.

description: Small molecule binding data for protein Cholinesterase, Uniprot P06276
DOI: 10.7270/q2125v9w
title: BindingDB Entry 50045089: The discovery of Polo-like kinase 4 inhibitors: design and optimization of spiro[cyclopropane-1,3'[3H]indol]-2'(1'H).ones as orally bioavailable antitumor agents.

description: Small molecule binding data for protein Aurora kinase B/Inner centromere protein, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Serine/threonine-protein kinase PLK1, Serine/threonine-protein kinase PLK2, Serine/threonine-protein kinase PLK3, Serine/threonine-protein kinase PLK4, Tyrosine-protein kinase receptor FLT3, and Vascular endothelial growth factor receptor 2, Uniprot O00444, P05177, P08684, P10635, P11712, P33261, P35968, P36888, P53350, Q96GD4, Q9H4B4, and Q9NYY3
DOI: 10.7270/q21n82kz
title: BindingDB Entry 50043413: TBA

description: Small molecule binding data for protein PI3-kinase subunit beta, Uniprot P42338
DOI: 10.7270/q2319xn0
title: BindingDB Entry 50046059: TBA

description: Small molecule binding data for protein Nitric Oxide Synthase, endothelial, Nitric Oxide Synthase, inducible, Nitric oxide synthase, brain, and Nitric-oxide synthase, brain, Uniprot P29473, P29475, P29476, and P29477
DOI: 10.7270/q23n24z2
title: BindingDB Entry 50044562: Easily accessible polycyclic amines that inhibit the wild-type and amantadine-resistant mutants of the M2 channel of influenza A virus.

description: Small molecule binding data for protein Matrix protein 2, Uniprot P0DOF5
DOI: 10.7270/q24j0gtx
title: BindingDB Entry 50045539: Synthesis and structure-activity relationships of a series of 4-methoxy-3-(piperidin-4-yl)oxy benzamides as novel inhibitors of the presynaptic choline transporter.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and High-affinity choline transporter, Uniprot P05177, P08684, P10635, P11712, and Q9GZV3
DOI: 10.7270/q24t6m0v
title: BindingDB Entry 50045088: Design and synthesis of novel and highly-active pan-histone deacetylase (pan-HDAC) inhibitors.

description: Small molecule binding data for protein Histone deacetylase, Histone deacetylase 1, Histone deacetylase 3/NCoR1, Histone deacetylase 4, and Histone deacetylase 8, Uniprot A0A024QZ26, O15379, P56524, Q13547, Q92769, Q9BY41, Q9UBN7, and Q9UKV0
DOI: 10.7270/q25d8t8v
title: BindingDB Entry 50043412: TBA

description: Small molecule binding data for protein Calcitonin gene-related peptide type 1 receptor, Uniprot Q16602
DOI: 10.7270/q28917jn
title: BindingDB Entry 50045538: Discovery of novel pyrazolopyrimidinone analogs as potent inhibitors of phosphodiesterase type-5.

description: Small molecule binding data for protein Phosphodiesterase 11A (PDE11A), Phosphodiesterase 1A (PDE1A), Phosphodiesterase 3 (PDE3), Phosphodiesterase 6C, Phosphodiesterase 7, Phosphodiesterase 8, Phosphodiesterase 9A, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4A, cGMP-dependent 3',5'-cyclic phosphodiesterase, and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O00408, O60658, O76074, O76083, P27815, P51160, P54750, Q13946, Q14432, Q9HCR9, and Q9Y233
DOI: 10.7270/q28k7bq5
title: BindingDB Entry 50045087: DDD-028: a potent potential non-opioid, non-cannabinoid analgesic for neuropathic and inflammatory pain.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 7 (5-HT7), Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A3, Alpha-1A adrenergic receptor, Alpha-1D adrenergic receptor, Alpha-2A adrenergic receptor, Alpha-2C adrenergic receptor, Cannabinoid receptor 1, Cannabinoid receptor 2, Serotonin receptor (2b and 2c), Sigma, and Somatostatin receptor, Uniprot P08913, P0DMS8, P18825, P21554, P25100, P28223, P29274, P30542, P30874, P31391, P34969, P34972, P35348, P41595, Q4W594, and Q99720
DOI: 10.7270/q2959jzq
title: BindingDB Entry 50043411: TBA

description: Small molecule binding data for protein Dopamine receptor D2L/neurotensin receptor NTS1, G-protein coupled receptor 35, Histamine H1 receptor, Serotonin 3 (5-HT3) receptor, Sigma, and Translocator protein, Uniprot P30536, P30989, P35367, P46098, Q99720, and Q9HC97
DOI: 10.7270/q2bg2qrv
title: BindingDB Entry 50046056: Optimization of a Series of Triazole Containing Mammalian Target of Rapamycin (mTOR) Kinase Inhibitors and the Discovery of CC-115.

description: Small molecule binding data for protein DNA-dependent protein kinase, Macrophage colony stimulating factor receptor, Mammalian target of Rapamycin (mTORC1), PI3-kinase subunit alpha, Phosphodiesterase 3, Serine-protein kinase ATM, Serine/threonine-protein kinase mTOR, and Voltage-gated potassium channel, Uniprot P07333, P42336, P42345, P62942, P78527, Q12809, Q13315, Q13370, and Q14432
DOI: 10.7270/q2c53nd4
title: BindingDB Entry 50044560: Development of second generation EP2 antagonists with high selectivity.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), Uniprot P28223
DOI: 10.7270/q2g73ggk
title: BindingDB Entry 50046055: Potent and Selective Amidopyrazole Inhibitors of IRAK4 That Are Efficacious in a Rodent Model of Inflammation.

description: Small molecule binding data for protein Interleukin-1 receptor-associated kinase 4, Uniprot Q9NWZ3
DOI: 10.7270/q2m04769
title: BindingDB Entry 50046054: Amino Acid Thioester Derivatives: A Highly Promising Scaffold for the Development of Metallo-ß-lactamase L1 Inhibitors.

description: Small molecule binding data for protein Beta-lactamase L1 and Beta-lactamase type II, Uniprot P25910 and P52700
DOI: 10.7270/q2mk6fkb
title: BindingDB Entry 50045543: A FRET-based assay for screening SIRT5 specific modulators.

description: Small molecule binding data for protein NAD-dependent protein deacetylase sirtuin-5 (SIRT5), Uniprot Q9NXA8
DOI: 10.7270/q2mw2jsv
title: BindingDB Entry 50045092: Structure-activity relationship and interaction studies of new SIRT1 inhibitors with the scaffold of 3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.

description: Small molecule binding data for protein NAD-Dependent Deacetylase Sirtuin-1, Uniprot Q96EB6
DOI: 10.7270/q2pc33tr
title: BindingDB Entry 50043408: TBA

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275