BDBM50535466 CHEMBL4457270

SMILES: N[C@@H](C1CCCCC1)C(=O)NCCCC(=O)Nc1cncc(C(O)=O)c1N

InChI Key: InChIKey=VMLAKMIRFIHBCH-HNNXBMFYSA-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 = 50535466   

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))	BDBM50535466 (CHEMBL4457270) Show SMILES N[C@@H](C1CCCCC1)C(=O)NCCCC(=O)Nc1cncc(C(O)=O)c1N |r| Show InChI InChI=1S/C18H27N5O4/c19-15(11-5-2-1-3-6-11)17(25)22-8-4-7-14(24)23-13-10-21-9-12(16(13)20)18(26)27/h9-11,15H,1-8,19H2,(H2,20,21)(H,22,25)(H,23,24)(H,26,27)/t15-/m0/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	1.62E+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