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SMILES: OC(=O)c1nc2ccc(I)cc2c2[nH]c3ccc(Cl)cc3c12

InChI Key: InChIKey=NNDIINYNYQTYFO-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50097871   

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
Mitogen-activated protein kinase 1 (Homo sapiens (Human))	BDBM50097871 (CHEMBL3589659) Show SMILES OC(=O)c1nc2ccc(I)cc2c2[nH]c3ccc(Cl)cc3c12 Show InChI InChI=1S/C16H8ClIN2O2/c17-7-1-3-11-9(5-7)13-14(19-11)10-6-8(18)2-4-12(10)20-15(13)16(21)22/h1-6,19H,(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Braunschweig Curated by ChEMBL					Assay Description Inhibition of ERK2 (unknown origin)				J Med Chem 58: 3131-43 (2015) Article DOI: 10.1021/jm501994d BindingDB Entry DOI: 10.7270/Q2736SPK
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM50097871 (CHEMBL3589659) Show SMILES OC(=O)c1nc2ccc(I)cc2c2[nH]c3ccc(Cl)cc3c12 Show InChI InChI=1S/C16H8ClIN2O2/c17-7-1-3-11-9(5-7)13-14(19-11)10-6-8(18)2-4-12(10)20-15(13)16(21)22/h1-6,19H,(H,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Braunschweig Curated by ChEMBL					Assay Description Inhibition of human recombinant DYRK1A expressed in Escherichia coli using RS peptide as substrate				J Med Chem 58: 3131-43 (2015) Article DOI: 10.1021/jm501994d BindingDB Entry DOI: 10.7270/Q2736SPK
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 5 (Homo sapiens (Human))	BDBM50097871 (CHEMBL3589659) Show SMILES OC(=O)c1nc2ccc(I)cc2c2[nH]c3ccc(Cl)cc3c12 Show InChI InChI=1S/C16H8ClIN2O2/c17-7-1-3-11-9(5-7)13-14(19-11)10-6-8(18)2-4-12(10)20-15(13)16(21)22/h1-6,19H,(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Braunschweig Curated by ChEMBL					Assay Description Inhibition of human recombinant CDK5 using [gamma-33P]ATP as substrate after 30 mins by scintillation counting analysis				J Med Chem 58: 3131-43 (2015) Article DOI: 10.1021/jm501994d BindingDB Entry DOI: 10.7270/Q2736SPK
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50097871 (CHEMBL3589659) Show SMILES OC(=O)c1nc2ccc(I)cc2c2[nH]c3ccc(Cl)cc3c12 Show InChI InChI=1S/C16H8ClIN2O2/c17-7-1-3-11-9(5-7)13-14(19-11)10-6-8(18)2-4-12(10)20-15(13)16(21)22/h1-6,19H,(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Braunschweig Curated by ChEMBL					Assay Description Inhibition of human recombinant CDK2 using [gamma-33P]ATP as substrate after 30 mins by scintillation counting analysis				J Med Chem 58: 3131-43 (2015) Article DOI: 10.1021/jm501994d BindingDB Entry DOI: 10.7270/Q2736SPK
					More data for this Ligand-Target Pair