BDBM50220683 CHEMBL432699

SMILES: COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1nc[nH]n1

InChI Key: InChIKey=DJAPMJWMZSZEPJ-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 = 50220683   

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))	BDBM50220683 (CHEMBL432699) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1nc[nH]n1 Show InChI InChI=1S/C15H19N5O3/c1-15(2,3)19-14(22)13(21)18-9-5-6-10(11(7-9)23-4)12-16-8-17-20-12/h5-8H,1-4H3,(H,18,21)(H,19,22)(H,16,17,20)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+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