BDBM50536176 CHEMBL4586184

SMILES: Cl.CC(=O)Nc1ccc(cc1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2n1

InChI Key: InChIKey=TXFUCGOTAVICDK-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50536176   

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
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50536176 (CHEMBL4586184) Show SMILES Cl.CC(=O)Nc1ccc(cc1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2n1 Show InChI InChI=1S/C26H23N7O/c1-16(34)30-19-8-6-18(7-9-19)22-12-13-23-26(31-22)33(20-10-4-17(15-27)5-11-20)25(32-23)21-3-2-14-29-24(21)28/h2-14H,15,27H2,1H3,(H2,28,29)(H,30,34)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
ArQule Inc. Curated by ChEMBL					Assay Description Inhibition of full length unphosphorylated AKT1 (1 to 480 residues) (unknown origin) expressed in baculovirus infected Sf9 insect cells using biotin-...				J Med Chem 59: 6455-69 (2016) Article DOI: 10.1021/acs.jmedchem.6b00619
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase AKT (Homo sapiens (Human))	BDBM50536176 (CHEMBL4586184) Show SMILES Cl.CC(=O)Nc1ccc(cc1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2n1 Show InChI InChI=1S/C26H23N7O/c1-16(34)30-19-8-6-18(7-9-19)22-12-13-23-26(31-22)33(20-10-4-17(15-27)5-11-20)25(32-23)21-3-2-14-29-24(21)28/h2-14H,15,27H2,1H3,(H2,28,29)(H,30,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
ArQule Inc. Curated by ChEMBL					Assay Description Inhibition of full length unphosphorylated AKT3 (1 to 479 residues) (unknown origin) expressed in baculovirus infected Sf9 insect cells using biotin-...				J Med Chem 59: 6455-69 (2016) Article DOI: 10.1021/acs.jmedchem.6b00619
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase AKT2 (Homo sapiens (Human))	BDBM50536176 (CHEMBL4586184) Show SMILES Cl.CC(=O)Nc1ccc(cc1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2n1 Show InChI InChI=1S/C26H23N7O/c1-16(34)30-19-8-6-18(7-9-19)22-12-13-23-26(31-22)33(20-10-4-17(15-27)5-11-20)25(32-23)21-3-2-14-29-24(21)28/h2-14H,15,27H2,1H3,(H2,28,29)(H,30,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
ArQule Inc. Curated by ChEMBL					Assay Description Inhibition of full length unphosphorylated AKT2 (1 to 481 residues) (unknown origin) expressed in baculovirus infected Sf9 insect cells using biotin-...				J Med Chem 59: 6455-69 (2016) Article DOI: 10.1021/acs.jmedchem.6b00619
					More data for this Ligand-Target Pair