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SMILES: COc1ccc2[nH]cc3C(C#N)=C(NC(C)c1c23)c1cccnc1

InChI Key: InChIKey=OXUUZSHNBFNQQK-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50208643   

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 5 activator 1 (Homo sapiens (Human))	BDBM50208643 (CHEMBL3885021) Show SMILES COc1ccc2[nH]cc3C(C#N)=C(NC(C)c1c23)c1cccnc1 |c:11| Show InChI InChI=1S/C19H16N4O/c1-11-17-16(24-2)6-5-15-18(17)14(10-22-15)13(8-20)19(23-11)12-4-3-7-21-9-12/h3-7,9-11,22-23H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant CDK5/p25 using histone H1 as substrate after 30 mins in presence of [gamma-33 P] ATP by liquid scintillation counting...				Eur J Med Chem 124: 920-934 (2016) Article DOI: 10.1016/j.ejmech.2016.08.069 BindingDB Entry DOI: 10.7270/Q24X59S3
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM50208643 (CHEMBL3885021) Show SMILES COc1ccc2[nH]cc3C(C#N)=C(NC(C)c1c23)c1cccnc1 |c:11| Show InChI InChI=1S/C19H16N4O/c1-11-17-16(24-2)6-5-15-18(17)14(10-22-15)13(8-20)19(23-11)12-4-3-7-21-9-12/h3-7,9-11,22-23H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
CNRS Curated by ChEMBL					Assay Description Inhibition of GST-tagged human recombinant DYRK1A expressed in Escherichia coli using RS peptide as substrate incubated for 30 mins in presence of [g...				Eur J Med Chem 124: 920-934 (2016) Article DOI: 10.1016/j.ejmech.2016.08.069 BindingDB Entry DOI: 10.7270/Q24X59S3
					More data for this Ligand-Target Pair
Dual specificity protein kinase CLK1 (Homo sapiens (Human))	BDBM50208643 (CHEMBL3885021) Show SMILES COc1ccc2[nH]cc3C(C#N)=C(NC(C)c1c23)c1cccnc1 |c:11| Show InChI InChI=1S/C19H16N4O/c1-11-17-16(24-2)6-5-15-18(17)14(10-22-15)13(8-20)19(23-11)12-4-3-7-21-9-12/h3-7,9-11,22-23H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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
CNRS Curated by ChEMBL					Assay Description Inhibition of GST-tagged human recombinant CLK1 expressed in Escherichia coli using RS peptide as substrate incubated for 30 mins in presence of [gam...				Eur J Med Chem 124: 920-934 (2016) Article DOI: 10.1016/j.ejmech.2016.08.069 BindingDB Entry DOI: 10.7270/Q24X59S3
					More data for this Ligand-Target Pair