BDBM50154963 CHEMBL3775680

SMILES: Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)NC2CC2)cc1

InChI Key: InChIKey=QOHBWKYBTSWNGX-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50154963   

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))	BDBM50154963 (CHEMBL3775680) Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)NC2CC2)cc1 Show InChI InChI=1S/C22H21N5O/c1-27-13-17(12-23-27)15-4-2-14(3-5-15)10-21-19-11-16(6-9-20(19)25-26-21)22(28)24-18-7-8-18/h2-6,9,11-13,18H,7-8,10H2,1H3,(H,24,28)(H,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Merck KGaA Curated by ChEMBL					Assay Description Inhibition of CDK8 (unknown origin) expressed in 7dF3 clone of human HEK293 cells preincubated for 2 hrs followed by addition of beta-estradiol by lu...				Bioorg Med Chem Lett 26: 1443-51 (2016) BindingDB Entry DOI: 10.7270/Q2NZ89G6
					More data for this Ligand-Target Pair
Cyclin-C (Homo sapiens (Human))	BDBM50154963 (CHEMBL3775680) Show SMILES Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(cc23)C(=O)NC2CC2)cc1 Show InChI InChI=1S/C22H21N5O/c1-27-13-17(12-23-27)15-4-2-14(3-5-15)10-21-19-11-16(6-9-20(19)25-26-21)22(28)24-18-7-8-18/h2-6,9,11-13,18H,7-8,10H2,1H3,(H,24,28)(H,25,26)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Merck KGaA Curated by ChEMBL					Assay Description Displacement of dye-labeled ATP competitive probe from recombinant human CDK8/Cyclin C incubated for 20 mins by Alexa647 probe-based FRET assay				Bioorg Med Chem Lett 26: 1443-51 (2016) BindingDB Entry DOI: 10.7270/Q2NZ89G6
					More data for this Ligand-Target Pair