BDBM50176582 3-(acetamidomethyl)-5-methyl-4-(4-phenoxyphenylamino)H-pyrrolo[1,2-b]pyridazine-6-carboxylic acid::CHEMBL201269

SMILES: CC(=O)NCc1cnn2cc(C(O)=O)c(C)c2c1Nc1ccc(Oc2ccccc2)cc1

InChI Key: InChIKey=JSRIRVZQAIVNDH-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 = 50176582   

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))	BDBM50176582 (3-(acetamidomethyl)-5-methyl-4-(4-phenoxyphenylami...) Show SMILES CC(=O)NCc1cnn2cc(C(O)=O)c(C)c2c1Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C24H22N4O4/c1-15-21(24(30)31)14-28-23(15)22(17(13-26-28)12-25-16(2)29)27-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,13-14,27H,12H2,1-2H3,(H,25,29)(H,30,31)	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	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against MEK				Bioorg Med Chem Lett 16: 628-32 (2005) Article DOI: 10.1016/j.bmcl.2005.10.052 BindingDB Entry DOI: 10.7270/Q2J67GHT
					More data for this Ligand-Target Pair