BDBM50535482 CHEMBL4522824

SMILES: CC(C)[C@@H](CCC(=O)Nc1cncc(C(O)=O)c1N)NC(=O)[C@@H](N)C1CCCCC1

InChI Key: InChIKey=CAAZAUKGLAKGFD-QAPCUYQASA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50535482   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
T1R2/T1R3 (Homo sapiens (Human))	BDBM50535482 (CHEMBL4522824) Show SMILES CC(C)[C@@H](CCC(=O)Nc1cncc(C(O)=O)c1N)NC(=O)[C@@H](N)C1CCCCC1 |r| Show InChI InChI=1S/C21H33N5O4/c1-12(2)15(26-20(28)18(22)13-6-4-3-5-7-13)8-9-17(27)25-16-11-24-10-14(19(16)23)21(29)30/h10-13,15,18H,3-9,22H2,1-2H3,(H2,23,24)(H,25,27)(H,26,28)(H,29,30)/t15-,18+/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	1.05E+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
					More data for this Ligand-Target Pair