BDBM50366794 CHEMBL1790637

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](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(=O)NO

InChI Key: InChIKey=WCDVLYGVHYYVCH-GWCVGUNGSA-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 = 50366794   

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 (4) (Homo sapiens (Human))	BDBM50366794 (CHEMBL1790637) 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](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(=O)NO Show InChI InChI=1S/C37H57N9O11/c1-8-18(4)29(44-32(51)25(13-14-27(38)50)41-35(54)30(19(5)47)40-21(7)49)34(53)45-31(20(6)48)36(55)42-26(33(52)43-28(17(2)3)37(56)46-57)15-22-16-39-24-12-10-9-11-23(22)24/h9-12,16-20,25-26,28-31,39,47-48,57H,8,13-15H2,1-7H3,(H2,38,50)(H,40,49)(H,41,54)(H,42,55)(H,43,52)(H,44,51)(H,45,53)(H,46,56)/t18-,19-,20-,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	4.21E+4	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