BDBM50295904 3-(1-(2-(1H-Imidazol-1-yl)ethyl)-1H-indol-3-yl)-4-(1Hpyrrolo[3,2-b]pyridin-1-yl)-1H-pyrrole-2,5-dione::CHEMBL558512

SMILES: O=C1NC(=O)C(=C1c1cn(CCn2ccnc2)c2ccccc12)n1ccc2ncccc12

InChI Key: InChIKey=QPIQPTBXCPADIC-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 = 50295904   

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
Protein kinase C, epsilon (Homo sapiens (Human))	BDBM50295904 (3-(1-(2-(1H-Imidazol-1-yl)ethyl)-1H-indol-3-yl)-4-...) Show SMILES O=C1NC(=O)C(=C1c1cn(CCn2ccnc2)c2ccccc12)n1ccc2ncccc12 |c:5| Show InChI InChI=1S/C24H18N6O2/c31-23-21(22(24(32)27-23)30-10-7-18-20(30)6-3-8-26-18)17-14-29(13-12-28-11-9-25-15-28)19-5-2-1-4-16(17)19/h1-11,14-15H,12-13H2,(H,27,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of recombinant PKCE expressed in Bac-to Bac baculovirus system				Bioorg Med Chem 17: 4302-12 (2009) Article DOI: 10.1016/j.bmc.2009.05.031 BindingDB Entry DOI: 10.7270/Q2XP750M
					More data for this Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta (Homo sapiens (Human))	BDBM50295904 (3-(1-(2-(1H-Imidazol-1-yl)ethyl)-1H-indol-3-yl)-4-...) Show SMILES O=C1NC(=O)C(=C1c1cn(CCn2ccnc2)c2ccccc12)n1ccc2ncccc12 |c:5| Show InChI InChI=1S/C24H18N6O2/c31-23-21(22(24(32)27-23)30-10-7-18-20(30)6-3-8-26-18)17-14-29(13-12-28-11-9-25-15-28)19-5-2-1-4-16(17)19/h1-11,14-15H,12-13H2,(H,27,31,32)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of recombinant IKK2 expressed in Bac-to Bac baculovirus system				Bioorg Med Chem 17: 4302-12 (2009) Article DOI: 10.1016/j.bmc.2009.05.031 BindingDB Entry DOI: 10.7270/Q2XP750M
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50295904 (3-(1-(2-(1H-Imidazol-1-yl)ethyl)-1H-indol-3-yl)-4-...) Show SMILES O=C1NC(=O)C(=C1c1cn(CCn2ccnc2)c2ccccc12)n1ccc2ncccc12 |c:5| Show InChI InChI=1S/C24H18N6O2/c31-23-21(22(24(32)27-23)30-10-7-18-20(30)6-3-8-26-18)17-14-29(13-12-28-11-9-25-15-28)19-5-2-1-4-16(17)19/h1-11,14-15H,12-13H2,(H,27,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-GSK3beta expressed in Escherichia coli BL21 (DE3)				Bioorg Med Chem 17: 4302-12 (2009) Article DOI: 10.1016/j.bmc.2009.05.031 BindingDB Entry DOI: 10.7270/Q2XP750M
					More data for this Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1 (Homo sapiens (Human))	BDBM50295904 (3-(1-(2-(1H-Imidazol-1-yl)ethyl)-1H-indol-3-yl)-4-...) Show SMILES O=C1NC(=O)C(=C1c1cn(CCn2ccnc2)c2ccccc12)n1ccc2ncccc12 |c:5| Show InChI InChI=1S/C24H18N6O2/c31-23-21(22(24(32)27-23)30-10-7-18-20(30)6-3-8-26-18)17-14-29(13-12-28-11-9-25-15-28)19-5-2-1-4-16(17)19/h1-11,14-15H,12-13H2,(H,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of recombinant MEK1 expressed in Escherichia coli				Bioorg Med Chem 17: 4302-12 (2009) Article DOI: 10.1016/j.bmc.2009.05.031 BindingDB Entry DOI: 10.7270/Q2XP750M
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 3 (Homo sapiens (Human))	BDBM50295904 (3-(1-(2-(1H-Imidazol-1-yl)ethyl)-1H-indol-3-yl)-4-...) Show SMILES O=C1NC(=O)C(=C1c1cn(CCn2ccnc2)c2ccccc12)n1ccc2ncccc12 |c:5| Show InChI InChI=1S/C24H18N6O2/c31-23-21(22(24(32)27-23)30-10-7-18-20(30)6-3-8-26-18)17-14-29(13-12-28-11-9-25-15-28)19-5-2-1-4-16(17)19/h1-11,14-15H,12-13H2,(H,27,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of recombinant ERK1 expressed in Escherichia coli				Bioorg Med Chem 17: 4302-12 (2009) Article DOI: 10.1016/j.bmc.2009.05.031 BindingDB Entry DOI: 10.7270/Q2XP750M
					More data for this Ligand-Target Pair
Aurora kinase A (Homo sapiens (Human))	BDBM50295904 (3-(1-(2-(1H-Imidazol-1-yl)ethyl)-1H-indol-3-yl)-4-...) Show SMILES O=C1NC(=O)C(=C1c1cn(CCn2ccnc2)c2ccccc12)n1ccc2ncccc12 |c:5| Show InChI InChI=1S/C24H18N6O2/c31-23-21(22(24(32)27-23)30-10-7-18-20(30)6-3-8-26-18)17-14-29(13-12-28-11-9-25-15-28)19-5-2-1-4-16(17)19/h1-11,14-15H,12-13H2,(H,27,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of recombinant Aurora A expressed in Escherichia coli				Bioorg Med Chem 17: 4302-12 (2009) Article DOI: 10.1016/j.bmc.2009.05.031 BindingDB Entry DOI: 10.7270/Q2XP750M
					More data for this Ligand-Target Pair