Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Taste receptor type 1 member 2/3' and Ligand = 'BDBM50535459'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Taste receptor type 1 member 2/3 (Homo sapiens (Human))	BDBM50535459 (CHEMBL4531637) Show SMILES CC(C)[C@@H](CC(=O)Nc1cncc(C(O)=O)c1N)NC(=O)[C@@H](N)C1CCCCC1 |r| Show InChI InChI=1S/C20H31N5O4/c1-11(2)14(25-19(27)17(21)12-6-4-3-5-7-12)8-16(26)24-15-10-23-9-13(18(15)22)20(28)29/h9-12,14,17H,3-8,21H2,1-2H3,(H2,22,23)(H,24,26)(H,25,27)(H,28,29)/t14-,17+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.84E+7	n/a	n/a	n/a	n/a
Ajinomoto Co., Inc. Curated by ChEMBL					Assay Description Positive allosteric modulator activity at human T1R2/T1R3 expressed in PEAKrapid cells assessed as potentiation of sucrose-induced intracellular calc...				ACS Med Chem Lett 10: 800-805 (2019) Article DOI: 10.1021/acsmedchemlett.9b00051 BindingDB Entry DOI: 10.7270/Q2348PXB
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