BDBM50535493 CHEMBL4465524

SMILES: CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N

InChI Key: InChIKey=QDVWKIWDKJSFEW-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 50535493   

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
Voltage-gated potassium channel subunit Kv7.1/Misshapen-like kinase 1 (Homo sapiens (Human))	BDBM50535493 (CHEMBL4465524) Show SMILES CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human 6His-TEV-Avi-MINK1(1 to 328)-GNS expressed in baculovirus-infected sf21 cells using LRRKtide as substrate preincubated for 30 min...				Bioorg Med Chem Lett 29: 1962-1967 (2019) Article DOI: 10.1016/j.bmcl.2019.05.032
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 4 (Homo sapiens (Human))	BDBM50535493 (CHEMBL4465524) Show SMILES CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human 6His-TEV-SHM-MAP4K4(2 to 328)-GNS expressed in baculovirus-infected sf21 cells using LRRKtide as substrate preincubated for 30 mi...				Bioorg Med Chem Lett 29: 1962-1967 (2019) Article DOI: 10.1016/j.bmcl.2019.05.032
					More data for this Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.1/Misshapen-like kinase 1 (Homo sapiens (Human))	BDBM50535493 (CHEMBL4465524) Show SMILES CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human full length MINK1(1-1332)-G5-Avi-6His-Flag expressed in baculovirus-infected sf21 cells using His6-SMAD1 as substrate preincubate...				Bioorg Med Chem Lett 29: 1962-1967 (2019) Article DOI: 10.1016/j.bmcl.2019.05.032
					More data for this Ligand-Target Pair
TRAF2- and NCK-interacting kinase (Homo sapiens (Human))	BDBM50535493 (CHEMBL4465524) Show SMILES CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<3.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human full length TNIK in HEK293 cells co-transfected with full length SMAD1 incubated for 2 hrs by ELISA				Bioorg Med Chem Lett 29: 1962-1967 (2019) Article DOI: 10.1016/j.bmcl.2019.05.032
					More data for this Ligand-Target Pair
TRAF2- and NCK-interacting kinase (Homo sapiens (Human))	BDBM50535493 (CHEMBL4465524) Show SMILES CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human full length TNIK(1-1360)-G5-Avi-6His-Flag expressed in baculovirus-infected sf21 cells using His6-SMAD1 as substrate preincubated...				Bioorg Med Chem Lett 29: 1962-1967 (2019) Article DOI: 10.1016/j.bmcl.2019.05.032
					More data for this Ligand-Target Pair
TRAF2- and NCK-interacting kinase (Homo sapiens (Human))	BDBM50535493 (CHEMBL4465524) Show SMILES CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human 6His-TEV-TNIK(1 to 325) expressed in baculovirus-infected sf21 cells using LRRKtide as substrate preincubated for 30 mins followe...				Bioorg Med Chem Lett 29: 1962-1967 (2019) Article DOI: 10.1016/j.bmcl.2019.05.032
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 4 (Homo sapiens (Human))	BDBM50535493 (CHEMBL4465524) Show SMILES CC(C)NC(=O)c1ccc(cc1)-c1cnc(N(C)C)c(c1)-c1ccc(cc1)C#N Show InChI InChI=1S/C24H24N4O/c1-16(2)27-24(29)20-11-9-18(10-12-20)21-13-22(23(26-15-21)28(3)4)19-7-5-17(14-25)6-8-19/h5-13,15-16H,1-4H3,(H,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human full length MAP4K4(1-1239)-G5-Avi-6His-Flag expressed in baculovirus-infected sf21 cells using His6-SMAD1 as substrate preincubat...				Bioorg Med Chem Lett 29: 1962-1967 (2019) Article DOI: 10.1016/j.bmcl.2019.05.032
					More data for this Ligand-Target Pair