BDBM50242618 CHEMBL4099804

SMILES: COc1cc2ncnc(Nc3cc([nH]n3)-c3ccc(Cl)cc3)c2cc1OC

InChI Key: InChIKey=XFVUOVJZXXGWDV-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50242618   

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
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM50242618 (CHEMBL4099804) Show SMILES COc1cc2ncnc(Nc3cc([nH]n3)-c3ccc(Cl)cc3)c2cc1OC Show InChI InChI=1S/C19H16ClN5O2/c1-26-16-7-13-15(8-17(16)27-2)21-10-22-19(13)23-18-9-14(24-25-18)11-3-5-12(20)6-4-11/h3-10H,1-2H3,(H2,21,22,23,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rajiv Gandhi Proudyogiki Vishwavidyalaya Curated by ChEMBL					Assay Description Inhibition of recombinant full length human GST-fused DYRK1A expressed in Escherichia coli using RS peptide as substrate after 30 mins in presence of...				Bioorg Med Chem Lett 27: 2663-2667 (2017) Article DOI: 10.1016/j.bmcl.2017.04.080 BindingDB Entry DOI: 10.7270/Q28P62X6
					More data for this Ligand-Target Pair
Dual specificity protein kinase CLK1 (Mus musculus)	BDBM50242618 (CHEMBL4099804) Show SMILES COc1cc2ncnc(Nc3cc([nH]n3)-c3ccc(Cl)cc3)c2cc1OC Show InChI InChI=1S/C19H16ClN5O2/c1-26-16-7-13-15(8-17(16)27-2)21-10-22-19(13)23-18-9-14(24-25-18)11-3-5-12(20)6-4-11/h3-10H,1-2H3,(H2,21,22,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rajiv Gandhi Proudyogiki Vishwavidyalaya Curated by ChEMBL					Assay Description Inhibition of recombinant mouse GST-fused CLK1 expressed in Escherichia coli using RS peptide as substrate after 30 mins in presence of ATP by scinti...				Bioorg Med Chem Lett 27: 2663-2667 (2017) Article DOI: 10.1016/j.bmcl.2017.04.080 BindingDB Entry DOI: 10.7270/Q28P62X6
					More data for this Ligand-Target Pair
Cyclin-A2/Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50242618 (CHEMBL4099804) Show SMILES COc1cc2ncnc(Nc3cc([nH]n3)-c3ccc(Cl)cc3)c2cc1OC Show InChI InChI=1S/C19H16ClN5O2/c1-26-16-7-13-15(8-17(16)27-2)21-10-22-19(13)23-18-9-14(24-25-18)11-3-5-12(20)6-4-11/h3-10H,1-2H3,(H2,21,22,23,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rajiv Gandhi Proudyogiki Vishwavidyalaya Curated by ChEMBL					Assay Description Inhibition of recombinant human CDK2/cyclin A using histone H1 as substrate after 30 mins in presence of ATP by scintillation counting method				Bioorg Med Chem Lett 27: 2663-2667 (2017) Article DOI: 10.1016/j.bmcl.2017.04.080 BindingDB Entry DOI: 10.7270/Q28P62X6
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1 (Homo sapiens (Human))	BDBM50242618 (CHEMBL4099804) Show SMILES COc1cc2ncnc(Nc3cc([nH]n3)-c3ccc(Cl)cc3)c2cc1OC Show InChI InChI=1S/C19H16ClN5O2/c1-26-16-7-13-15(8-17(16)27-2)21-10-22-19(13)23-18-9-14(24-25-18)11-3-5-12(20)6-4-11/h3-10H,1-2H3,(H2,21,22,23,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rajiv Gandhi Proudyogiki Vishwavidyalaya Curated by ChEMBL					Assay Description Inhibition of recombinant human CDK5/p25 expressed in Escherichia coli using histone H1 as substrate after 30 mins in presence of ATP by scintillatio...				Bioorg Med Chem Lett 27: 2663-2667 (2017) Article DOI: 10.1016/j.bmcl.2017.04.080 BindingDB Entry DOI: 10.7270/Q28P62X6
					More data for this Ligand-Target Pair
Cyclin-T1/Cyclin-dependent kinase 9 (Homo sapiens (Human))	BDBM50242618 (CHEMBL4099804) Show SMILES COc1cc2ncnc(Nc3cc([nH]n3)-c3ccc(Cl)cc3)c2cc1OC Show InChI InChI=1S/C19H16ClN5O2/c1-26-16-7-13-15(8-17(16)27-2)21-10-22-19(13)23-18-9-14(24-25-18)11-3-5-12(20)6-4-11/h3-10H,1-2H3,(H2,21,22,23,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Rajiv Gandhi Proudyogiki Vishwavidyalaya Curated by ChEMBL					Assay Description Inhibition of recombinant human CDK9/cyclin T expressed in insect cells using YSPTSPSYSPTSPSYSPTSPSKKKK as substrate after 30 mins in presence of ATP...				Bioorg Med Chem Lett 27: 2663-2667 (2017) Article DOI: 10.1016/j.bmcl.2017.04.080 BindingDB Entry DOI: 10.7270/Q28P62X6
					More data for this Ligand-Target Pair