BDBM50369809 CHEMBL1790321

SMILES: CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)NCCc1ccccc1

InChI Key: InChIKey=WENIFQMEMQETQU-YBMCAPFMSA-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 = 50369809   

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
FK506 binding protein 4 (Homo sapiens (Human))	BDBM50369809 (CHEMBL1790321) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)NCCc1ccccc1 Show InChI InChI=1S/C37H55N9O7/c1-7-23(4)32(36(52)39-16-15-26-12-9-8-10-13-26)45-35(51)29-14-11-17-46(29)30(48)20-40-33(49)24(5)42-34(50)28(18-27-19-38-21-41-27)44-37(53)31(22(2)3)43-25(6)47/h8-10,12-13,19,21-24,28-29,31-32H,7,11,14-18,20H2,1-6H3,(H,38,41)(H,39,52)(H,40,49)(H,42,50)(H,43,47)(H,44,53)(H,45,51)/t23-,24-,28-,29-,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.25E+5	n/a	n/a	n/a	n/a	n/a	n/a
D�partement D'Ing�nierie et D'Etudes des Prot�ines Curated by ChEMBL					Assay Description 50% inhibitory concentration of competitive binding against hCyp-18 PPIase activity using uncoupled assay				J Med Chem 43: 1770-9 (2000) BindingDB Entry DOI: 10.7270/Q2SQ9135
					More data for this Ligand-Target Pair