null

SMILES: CN1CCC(CC1)c1ccc(Nc2ncc3c(n2)n2ccnc2n(-c2ccccc2Cl)c3=O)cc1

InChI Key: InChIKey=HLCFJKUJLMXDCF-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50043638   

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
Wee1-like protein kinase (Homo sapiens (Human))	BDBM50043638 (CHEMBL3355523) Show SMILES CN1CCC(CC1)c1ccc(Nc2ncc3c(n2)n2ccnc2n(-c2ccccc2Cl)c3=O)cc1 |(11.11,-34.48,;11.12,-32.94,;9.79,-32.16,;9.8,-30.63,;11.13,-29.86,;12.47,-30.63,;12.46,-32.18,;11.13,-28.33,;9.8,-27.55,;9.8,-26.02,;11.14,-25.25,;11.15,-23.71,;9.81,-22.94,;9.82,-21.39,;8.48,-20.62,;7.15,-21.39,;7.15,-22.93,;8.48,-23.7,;5.82,-23.69,;5.49,-25.19,;3.97,-25.34,;3.36,-23.94,;4.5,-22.92,;4.49,-21.38,;3.16,-20.61,;1.82,-21.38,;.49,-20.61,;.49,-19.06,;1.82,-18.29,;3.15,-19.06,;4.48,-18.28,;5.82,-20.61,;5.82,-19.07,;12.47,-26.02,;12.47,-27.55,)| Show InChI InChI=1S/C26H24ClN7O/c1-32-13-10-18(11-14-32)17-6-8-19(9-7-17)30-25-29-16-20-23(31-25)33-15-12-28-26(33)34(24(20)35)22-5-3-2-4-21(22)27/h2-9,12,15-16,18H,10-11,13-14H2,1H3,(H,29,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	8.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AbbVie Curated by ChEMBL					Assay Description Inhibition of GST-tagged human Wee1				ACS Med Chem Lett 6: 58-62 (2015) Article DOI: 10.1021/ml5002745 BindingDB Entry DOI: 10.7270/Q2NZ8972
					More data for this Ligand-Target Pair
Wee1-like protein kinase (Homo sapiens (Human))	BDBM50043638 (CHEMBL3355523) Show SMILES CN1CCC(CC1)c1ccc(Nc2ncc3c(n2)n2ccnc2n(-c2ccccc2Cl)c3=O)cc1 |(11.11,-34.48,;11.12,-32.94,;9.79,-32.16,;9.8,-30.63,;11.13,-29.86,;12.47,-30.63,;12.46,-32.18,;11.13,-28.33,;9.8,-27.55,;9.8,-26.02,;11.14,-25.25,;11.15,-23.71,;9.81,-22.94,;9.82,-21.39,;8.48,-20.62,;7.15,-21.39,;7.15,-22.93,;8.48,-23.7,;5.82,-23.69,;5.49,-25.19,;3.97,-25.34,;3.36,-23.94,;4.5,-22.92,;4.49,-21.38,;3.16,-20.61,;1.82,-21.38,;.49,-20.61,;.49,-19.06,;1.82,-18.29,;3.15,-19.06,;4.48,-18.28,;5.82,-20.61,;5.82,-19.07,;12.47,-26.02,;12.47,-27.55,)| Show InChI InChI=1S/C26H24ClN7O/c1-32-13-10-18(11-14-32)17-6-8-19(9-7-17)30-25-29-16-20-23(31-25)33-15-12-28-26(33)34(24(20)35)22-5-3-2-4-21(22)27/h2-9,12,15-16,18H,10-11,13-14H2,1H3,(H,29,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a
AbbVie Curated by ChEMBL					Assay Description Inhibition of human Weel1 in human NCI-H1299 cells assessed as phosphorylation of Cdk1 after overnight incubation by ELISA PD assay				ACS Med Chem Lett 6: 58-62 (2015) Article DOI: 10.1021/ml5002745 BindingDB Entry DOI: 10.7270/Q2NZ8972
					More data for this Ligand-Target Pair