BDBM50438730 CHEMBL2414675

SMILES: Cc1noc(CC[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)n1

InChI Key: InChIKey=AITZPAZXUJQGAT-QAQDUYKDSA-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 = 50438730   

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
Diacylglycerol O-acyltransferase 1 (DGAT1) (Homo sapiens (Human))	BDBM50438730 (CHEMBL2414675) Show SMILES Cc1noc(CC[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)n1 |r,wU:10.13,wD:7.6,(40.74,-42.42,;39.26,-42.85,;38.05,-41.9,;36.77,-42.77,;37.22,-44.27,;36.25,-45.5,;34.74,-45.28,;33.77,-46.51,;32.26,-46.28,;31.32,-47.48,;31.9,-48.94,;33.39,-49.12,;34.34,-47.92,;30.94,-50.16,;29.42,-49.94,;28.48,-51.14,;29.05,-52.58,;30.56,-52.78,;31.5,-51.58,;28.09,-53.79,;28.79,-55.18,;28.14,-56.58,;26.64,-56.95,;25.42,-55.99,;24.09,-56.78,;22.74,-56.03,;22.72,-54.49,;24.05,-53.7,;24.03,-52.16,;25.4,-54.45,;26.59,-53.47,;26.22,-51.97,;38.74,-44.3,)| Show InChI InChI=1S/C24H28N6O3/c1-15-28-20(33-29-15)11-4-16-2-5-17(6-3-16)18-7-9-19(10-8-18)30-12-13-32-23-21(24(30)31)22(25)26-14-27-23/h7-10,14,16-17H,2-6,11-13H2,1H3,(H2,25,26,27)/t16-,17-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human full length DGAT-1 expressed in insect sf9 cells using [14C]decanoylCoA as substrate after 1.5 hrs by scintillation spectrometry				Bioorg Med Chem 21: 5081-97 (2013) Article DOI: 10.1016/j.bmc.2013.06.045 BindingDB Entry DOI: 10.7270/Q26111RG
					More data for this Ligand-Target Pair
Diacylglycerol O-acyltransferase 1 (DGAT1) (Homo sapiens (Human))	BDBM50438730 (CHEMBL2414675) Show SMILES Cc1noc(CC[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)n1 |r,wU:10.13,wD:7.6,(40.74,-42.42,;39.26,-42.85,;38.05,-41.9,;36.77,-42.77,;37.22,-44.27,;36.25,-45.5,;34.74,-45.28,;33.77,-46.51,;32.26,-46.28,;31.32,-47.48,;31.9,-48.94,;33.39,-49.12,;34.34,-47.92,;30.94,-50.16,;29.42,-49.94,;28.48,-51.14,;29.05,-52.58,;30.56,-52.78,;31.5,-51.58,;28.09,-53.79,;28.79,-55.18,;28.14,-56.58,;26.64,-56.95,;25.42,-55.99,;24.09,-56.78,;22.74,-56.03,;22.72,-54.49,;24.05,-53.7,;24.03,-52.16,;25.4,-54.45,;26.59,-53.47,;26.22,-51.97,;38.74,-44.3,)| Show InChI InChI=1S/C24H28N6O3/c1-15-28-20(33-29-15)11-4-16-2-5-17(6-3-16)18-7-9-19(10-8-18)30-12-13-32-23-21(24(30)31)22(25)26-14-27-23/h7-10,14,16-17H,2-6,11-13H2,1H3,(H2,25,26,27)/t16-,17-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of DGAT-1-mediated triglyceride synthesis in human HT-29 cells using [3H]-glycerol as substrate incubated for 1 hr prior to substrate addi...				Bioorg Med Chem 21: 5081-97 (2013) Article DOI: 10.1016/j.bmc.2013.06.045 BindingDB Entry DOI: 10.7270/Q26111RG
					More data for this Ligand-Target Pair