BDBM50220614 CHEMBL296923

SMILES: CCCCc1ncoc1-c1ccc(NC(=O)C(=O)NC(C)(C)C)cc1OC

InChI Key: InChIKey=YFWWMMKSEBPKNQ-UHFFFAOYSA-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 = 50220614   

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
Inosine-5'-monophosphate dehydrogenase (IMPDH) (Homo sapiens (Human))	BDBM50220614 (CHEMBL296923) Show SMILES CCCCc1ncoc1-c1ccc(NC(=O)C(=O)NC(C)(C)C)cc1OC Show InChI InChI=1S/C20H27N3O4/c1-6-7-8-15-17(27-12-21-15)14-10-9-13(11-16(14)26-5)22-18(24)19(25)23-20(2,3)4/h9-12H,6-8H2,1-5H3,(H,22,24)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair