BDBM50279535 4-(2,6-dichlorophenyl)-9-hydroxy-6-(4-morpholino-4-oxobutyl)pyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione::CHEMBL483611

SMILES: Oc1ccc2n(CCCC(=O)N3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl

InChI Key: InChIKey=XLSPNAOIFCAQFU-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 = 50279535   

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
Serine/threonine-protein kinase WEE1 (Homo sapiens (Human))	BDBM50279535 (4-(2,6-dichlorophenyl)-9-hydroxy-6-(4-morpholino-4...) Show SMILES Oc1ccc2n(CCCC(=O)N3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl |(5.42,-7.62,;6.62,-8.58,;6.38,-10.11,;7.59,-11.07,;9.02,-10.51,;10.4,-11.21,;10.47,-12.75,;11.83,-13.46,;11.89,-15,;13.25,-15.72,;14.56,-14.9,;13.32,-17.26,;12.01,-18.07,;12.07,-19.6,;13.43,-20.32,;14.73,-19.5,;14.68,-17.96,;11.54,-10.18,;13.08,-10.21,;13.89,-8.88,;13.12,-7.53,;13.63,-6.08,;15.1,-5.63,;12.4,-5.15,;11.14,-6.03,;9.69,-5.52,;11.59,-7.5,;10.79,-8.82,;9.25,-8.98,;8.05,-8.02,;15.42,-8.9,;16.17,-10.25,;15.37,-11.57,;17.7,-10.27,;18.5,-8.95,;17.74,-7.6,;16.2,-7.58,;15.45,-6.24,)| Show InChI InChI=1S/C28H23Cl2N3O5/c29-18-3-1-4-19(30)23(18)17-14-21-24(26-25(17)27(36)31-28(26)37)16-13-15(34)6-7-20(16)33(21)8-2-5-22(35)32-9-11-38-12-10-32/h1,3-4,6-7,13-14,34H,2,5,8-12H2,(H,31,36,37)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
Chulalongkorn University Curated by ChEMBL					Assay Description Inhibition of human Wee1				Eur J Med Chem 44: 1383-95 (2009) Article DOI: 10.1016/j.ejmech.2008.09.027 BindingDB Entry DOI: 10.7270/Q2X34XB6
					More data for this Ligand-Target Pair