BDBM50390499 CHEMBL2071613

SMILES: Cc1ccc(Nc2nc3ccc(cc3[nH]2)C#N)cc1

InChI Key: InChIKey=BTMILTGAEMVSJA-UHFFFAOYSA-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 = 50390499   

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
Casein kinase I isoform alpha (Homo sapiens (Human))	BDBM50390499 (CHEMBL2071613) Show SMILES Cc1ccc(Nc2nc3ccc(cc3[nH]2)C#N)cc1 Show InChI InChI=1S/C15H12N4/c1-10-2-5-12(6-3-10)17-15-18-13-7-4-11(9-16)8-14(13)19-15/h2-8H,1H3,(H2,17,18,19)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.97E+4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of CK1alpha by Lance assay				Bioorg Med Chem Lett 22: 5392-5 (2012) Article DOI: 10.1016/j.bmcl.2012.07.046 BindingDB Entry DOI: 10.7270/Q2CF9R6Q
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50390499 (CHEMBL2071613) Show SMILES Cc1ccc(Nc2nc3ccc(cc3[nH]2)C#N)cc1 Show InChI InChI=1S/C15H12N4/c1-10-2-5-12(6-3-10)17-15-18-13-7-4-11(9-16)8-14(13)19-15/h2-8H,1H3,(H2,17,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of GSK3beta by AlphaScreen assay				Bioorg Med Chem Lett 22: 5392-5 (2012) Article DOI: 10.1016/j.bmcl.2012.07.046 BindingDB Entry DOI: 10.7270/Q2CF9R6Q
					More data for this Ligand-Target Pair
Casein kinase I (Homo sapiens (Human))	BDBM50390499 (CHEMBL2071613) Show SMILES Cc1ccc(Nc2nc3ccc(cc3[nH]2)C#N)cc1 Show InChI InChI=1S/C15H12N4/c1-10-2-5-12(6-3-10)17-15-18-13-7-4-11(9-16)8-14(13)19-15/h2-8H,1H3,(H2,17,18,19)	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	4.54E+3	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of CK1gamma2 expressed in HEK293 cells assessed as inhibition of LRP6 Thr1479 phosphorylation by immunoblotting				Bioorg Med Chem Lett 22: 5392-5 (2012) Article DOI: 10.1016/j.bmcl.2012.07.046 BindingDB Entry DOI: 10.7270/Q2CF9R6Q
					More data for this Ligand-Target Pair
Casein kinase I isoform delta (Homo sapiens (Human))	BDBM50390499 (CHEMBL2071613) Show SMILES Cc1ccc(Nc2nc3ccc(cc3[nH]2)C#N)cc1 Show InChI InChI=1S/C15H12N4/c1-10-2-5-12(6-3-10)17-15-18-13-7-4-11(9-16)8-14(13)19-15/h2-8H,1H3,(H2,17,18,19)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of CK1delta by Lance assay				Bioorg Med Chem Lett 22: 5392-5 (2012) Article DOI: 10.1016/j.bmcl.2012.07.046 BindingDB Entry DOI: 10.7270/Q2CF9R6Q
					More data for this Ligand-Target Pair