BDBM50366789 CHEMBL2369613

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)C(=O)N[C@@H]([C@@H](O)CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(O)=O

InChI Key: InChIKey=LNGOLIFQRPGTIP-ZORAIWARSA-N

Data: 1 IC50

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 = 50366789   

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
Membrane-associated guanylate kinase, WW and PDZ domain-containing protein 3 (Homo sapiens (Human))	BDBM50366789 (CHEMBL2369613) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)C(=O)N[C@@H]([C@@H](O)CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(O)=O Show InChI InChI=1S/C37H56N8O12/c1-7-18(4)29(44-32(51)24(12-13-27(38)50)41-35(54)30(19(5)47)40-20(6)48)34(53)45-31(26(49)16-46)36(55)42-25(33(52)43-28(17(2)3)37(56)57)14-21-15-39-23-11-9-8-10-22(21)23/h8-11,15,17-19,24-26,28-31,39,46-47,49H,7,12-14,16H2,1-6H3,(H2,38,50)(H,40,48)(H,41,54)(H,42,55)(H,43,52)(H,44,51)(H,45,53)(H,56,57)/t18-,19+,24-,25-,26-,28-,29-,30-,31-/m0/s1	PDB KEGG B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibitory concentration for MAGI-3 PDZ2 domain				Bioorg Med Chem Lett 12: 2471-4 (2002) BindingDB Entry DOI: 10.7270/Q2HQ40FV
					More data for this Ligand-Target Pair