BDBM50347764 CHEMBL1802847

SMILES: CC(C)CCNC1=NC(=Cc2ccc3OCOc3c2)C(=O)N1C

InChI Key: InChIKey=DQUFBQPETORSKP-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50347764   

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 protein kinase CLK1 (Mus musculus)	BDBM50347764 (CHEMBL1802847) Show SMILES CC(C)CCNC1=NC(=Cc2ccc3OCOc3c2)C(=O)N1C |w:9.9,t:6| Show InChI InChI=1S/C17H21N3O3/c1-11(2)6-7-18-17-19-13(16(21)20(17)3)8-12-4-5-14-15(9-12)23-10-22-14/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? de Rennes 1 Curated by ChEMBL					Assay Description Inhibition of mouse recombinant GST-tagged CLK1 using GRSRSRSRSRSR as substrate				J Med Chem 54: 4172-86 (2011) Article DOI: 10.1021/jm200274d BindingDB Entry DOI: 10.7270/Q27D2VHR
					More data for this Ligand-Target Pair
Dual specificity protein kinase CLK3 (Mus musculus)	BDBM50347764 (CHEMBL1802847) Show SMILES CC(C)CCNC1=NC(=Cc2ccc3OCOc3c2)C(=O)N1C |w:9.9,t:6| Show InChI InChI=1S/C17H21N3O3/c1-11(2)6-7-18-17-19-13(16(21)20(17)3)8-12-4-5-14-15(9-12)23-10-22-14/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? de Rennes 1 Curated by ChEMBL					Assay Description Inhibition of mouse recombinant GST-tagged CLK3 using GRSRSRSRSRSR as substrate				J Med Chem 54: 4172-86 (2011) Article DOI: 10.1021/jm200274d BindingDB Entry DOI: 10.7270/Q27D2VHR
					More data for this Ligand-Target Pair
Cyclin-Dependent Kinase 5 (CDK5) (Homo sapiens (Human))	BDBM50347764 (CHEMBL1802847) Show SMILES CC(C)CCNC1=NC(=Cc2ccc3OCOc3c2)C(=O)N1C |w:9.9,t:6| Show InChI InChI=1S/C17H21N3O3/c1-11(2)6-7-18-17-19-13(16(21)20(17)3)8-12-4-5-14-15(9-12)23-10-22-14/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? de Rennes 1 Curated by ChEMBL					Assay Description Inhibition of human recombinant CDK5/p25				J Med Chem 54: 4172-86 (2011) Article DOI: 10.1021/jm200274d BindingDB Entry DOI: 10.7270/Q27D2VHR
					More data for this Ligand-Target Pair
Dual-specificity tyrosine-phosphorylation regulated kinase 2 (Homo sapiens (Human))	BDBM50347764 (CHEMBL1802847) Show SMILES CC(C)CCNC1=NC(=Cc2ccc3OCOc3c2)C(=O)N1C |w:9.9,t:6| Show InChI InChI=1S/C17H21N3O3/c1-11(2)6-7-18-17-19-13(16(21)20(17)3)8-12-4-5-14-15(9-12)23-10-22-14/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,18,19)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? de Rennes 1 Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged DYRK2 using KKISGRLSPIMTEQ as substrate and [gamma32]-ATP after 30 mins by scintillation counting				J Med Chem 54: 4172-86 (2011) Article DOI: 10.1021/jm200274d BindingDB Entry DOI: 10.7270/Q27D2VHR
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase pim-1 (Homo sapiens (Human))	BDBM50347764 (CHEMBL1802847) Show SMILES CC(C)CCNC1=NC(=Cc2ccc3OCOc3c2)C(=O)N1C |w:9.9,t:6| Show InChI InChI=1S/C17H21N3O3/c1-11(2)6-7-18-17-19-13(16(21)20(17)3)8-12-4-5-14-15(9-12)23-10-22-14/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,18,19)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? de Rennes 1 Curated by ChEMBL					Assay Description Inhibition of human recombinant Pim1				J Med Chem 54: 4172-86 (2011) Article DOI: 10.1021/jm200274d BindingDB Entry DOI: 10.7270/Q27D2VHR
					More data for this Ligand-Target Pair
Dual-specificity tyrosine-(Y)-phosphorylation regulated kinase 1A (RAT)	BDBM50347764 (CHEMBL1802847) Show SMILES CC(C)CCNC1=NC(=Cc2ccc3OCOc3c2)C(=O)N1C |w:9.9,t:6| Show InChI InChI=1S/C17H21N3O3/c1-11(2)6-7-18-17-19-13(16(21)20(17)3)8-12-4-5-14-15(9-12)23-10-22-14/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Universite£? de Rennes 1 Curated by ChEMBL					Assay Description Inhibition of rat recombinant GST-tagged DYRK1A using KKISGRLSPIMTEQ as substrate and [gamma32]-ATP after 30 mins by scintillation counting				J Med Chem 54: 4172-86 (2011) Article DOI: 10.1021/jm200274d BindingDB Entry DOI: 10.7270/Q27D2VHR
					More data for this Ligand-Target Pair