BDBM50366791 CHEMBL1790640

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)[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(O)=O

InChI Key: InChIKey=QVSZGEFZTPPQDH-LLLFOABASA-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 = 50366791   

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))	BDBM50366791 (CHEMBL1790640) 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)[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C(C)C)C(O)=O Show InChI InChI=1S/C38H58N8O11/c1-9-19(4)30(44-33(51)26(14-15-28(39)50)42-36(54)31(20(5)47)41-22(7)49)35(53)45-32(21(6)48)37(55)46(8)27(34(52)43-29(18(2)3)38(56)57)16-23-17-40-25-13-11-10-12-24(23)25/h10-13,17-21,26-27,29-32,40,47-48H,9,14-16H2,1-8H3,(H2,39,50)(H,41,49)(H,42,54)(H,43,52)(H,44,51)(H,45,53)(H,56,57)/t19-,20-,21-,26-,27-,29-,30-,31-,32-/m0/s1	PDB KEGG B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.06E+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