BDBM50532614 CHEMBL4566932

SMILES: CNc1nccc(n1)N1CC[C@@H](C1)NC(=O)Nc1ccc(Cl)c(c1)C(F)(F)F

InChI Key: InChIKey=AUXBXQOZTPVFRD-NSHDSACASA-N

Data: 4 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 4 hits for monomerid = 50532614   

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
Cyclin-dependent kinase 8 (Homo sapiens (Human))	BDBM50532614 (CHEMBL4566932) Show SMILES CNc1nccc(n1)N1CC[C@@H](C1)NC(=O)Nc1ccc(Cl)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C17H18ClF3N6O/c1-22-15-23-6-4-14(26-15)27-7-5-11(9-27)25-16(28)24-10-2-3-13(18)12(8-10)17(19,20)21/h2-4,6,8,11H,5,7,9H2,1H3,(H,22,23,26)(H2,24,25,28)/t11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of CDK8 in IFN-gamma-induced human HCT116 cells assessed as suppression of STAT1 phosphorylation at serine727 residue incubated for 24 hrs...				ACS Med Chem Lett 7: 595-600 (2016) Article DOI: 10.1021/acsmedchemlett.6b00044
					More data for this Ligand-Target Pair
Cyclin-C (Homo sapiens (Human))	BDBM50532614 (CHEMBL4566932) Show SMILES CNc1nccc(n1)N1CC[C@@H](C1)NC(=O)Nc1ccc(Cl)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C17H18ClF3N6O/c1-22-15-23-6-4-14(26-15)27-7-5-11(9-27)25-16(28)24-10-2-3-13(18)12(8-10)17(19,20)21/h2-4,6,8,11H,5,7,9H2,1H3,(H,22,23,26)(H2,24,25,28)/t11-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Displacement of tracer236 from full-length His-tagged CDK8/cyclin C (unknown origin) incubated for 1 hr by TR-FRET analysis				ACS Med Chem Lett 7: 595-600 (2016) Article DOI: 10.1021/acsmedchemlett.6b00044
					More data for this Ligand-Target Pair
Cyclin-C (Homo sapiens (Human))	BDBM50532614 (CHEMBL4566932) Show SMILES CNc1nccc(n1)N1CC[C@@H](C1)NC(=O)Nc1ccc(Cl)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C17H18ClF3N6O/c1-22-15-23-6-4-14(26-15)27-7-5-11(9-27)25-16(28)24-10-2-3-13(18)12(8-10)17(19,20)21/h2-4,6,8,11H,5,7,9H2,1H3,(H,22,23,26)(H2,24,25,28)/t11-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Displacement of tracer236 from full-length His-tagged CDK8/cyclin C (unknown origin) incubated for 1 hr by TR-FRET analysis				ACS Med Chem Lett 7: 595-600 (2016) Article DOI: 10.1021/acsmedchemlett.6b00044
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 8 (Homo sapiens (Human))	BDBM50532614 (CHEMBL4566932) Show SMILES CNc1nccc(n1)N1CC[C@@H](C1)NC(=O)Nc1ccc(Cl)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C17H18ClF3N6O/c1-22-15-23-6-4-14(26-15)27-7-5-11(9-27)25-16(28)24-10-2-3-13(18)12(8-10)17(19,20)21/h2-4,6,8,11H,5,7,9H2,1H3,(H,22,23,26)(H2,24,25,28)/t11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of CDK8 in IFN-gamma-induced human HCT116 cells assessed as suppression of STAT1 phosphorylation at serine727 residue incubated for 24 hrs...				ACS Med Chem Lett 7: 595-600 (2016) Article DOI: 10.1021/acsmedchemlett.6b00044
					More data for this Ligand-Target Pair