BDBM50187818 5-(2-chloro-4-iodophenylamino)-3-hydroxy-N-(1-hydroxypropan-2-yl)isothiazole-4-carboxamidine::CHEMBL213167

SMILES: CC(CO)NC(=N)c1c(Nc2ccc(I)cc2Cl)s[nH]c1=O

InChI Key: InChIKey=HIIZJKXCRQSARC-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 = 50187818   

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
Dual specificity mitogen-activated protein kinase kinase 1 (Homo sapiens (Human))	BDBM50187818 (5-(2-chloro-4-iodophenylamino)-3-hydroxy-N-(1-hydr...) Show SMILES CC(CO)NC(=N)c1c(Nc2ccc(I)cc2Cl)s[nH]c1=O Show InChI InChI=1S/C13H14ClIN4O2S/c1-6(5-20)17-11(16)10-12(21)19-22-13(10)18-9-3-2-7(15)4-8(9)14/h2-4,6,18,20H,5H2,1H3,(H2,16,17)(H,19,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
Valeant Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Inhibition of MEK1				Bioorg Med Chem Lett 16: 3975-80 (2006) Article DOI: 10.1016/j.bmcl.2006.05.019 BindingDB Entry DOI: 10.7270/Q2SJ1K6C
					More data for this Ligand-Target Pair