BDBM92493 Alkaloid 2

SMILES: CCCCCNC(=O)O[C@@H]1CC[C@@H]2[C@H](C[C@H]1N2CCC(C)C)C(=O)Nc1ccc(cc1)N(C)C

InChI Key: InChIKey=BTOSCLDHCFIRKM-ZYQDXHPFSA-N

Data: 2 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 2 hits for monomerid = 92493   

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))	BDBM92493 (Alkaloid 2) Show SMILES CCCCCNC(=O)O[C@@H]1CC[C@@H]2[C@H](C[C@H]1N2CCC(C)C)C(=O)Nc1ccc(cc1)N(C)C |r,THB:17:16:13.14:9.11.10| Show InChI InChI=1S/C27H44N4O3/c1-6-7-8-16-28-27(33)34-25-14-13-23-22(18-24(25)31(23)17-15-19(2)3)26(32)29-20-9-11-21(12-10-20)30(4)5/h9-12,19,22-25H,6-8,13-18H2,1-5H3,(H,28,33)(H,29,32)/t22-,23+,24+,25+/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories					Assay Description 384-Well TR-Fret assay using AKT-tide peptide substrate.				J Biol Chem 285: 18838-46 (2010) Article DOI: 10.1074/jbc.M109.089946 BindingDB Entry DOI: 10.7270/Q2PV6J0B
					More data for this Ligand-Target Pair
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human))	BDBM92493 (Alkaloid 2) Show SMILES CCCCCNC(=O)O[C@@H]1CC[C@@H]2[C@H](C[C@H]1N2CCC(C)C)C(=O)Nc1ccc(cc1)N(C)C |r,THB:17:16:13.14:9.11.10| Show InChI InChI=1S/C27H44N4O3/c1-6-7-8-16-28-27(33)34-25-14-13-23-22(18-24(25)31(23)17-15-19(2)3)26(32)29-20-9-11-21(12-10-20)30(4)5/h9-12,19,22-25H,6-8,13-18H2,1-5H3,(H,28,33)(H,29,32)/t22-,23+,24+,25+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories					Assay Description 1536-Well TR-Fret uHTS assay PDK1-tide1 peptide substrate.				J Biol Chem 285: 18838-46 (2010) Article DOI: 10.1074/jbc.M109.089946 BindingDB Entry DOI: 10.7270/Q2PV6J0B
					More data for this Ligand-Target Pair