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BDBM209554 US9271969, 42

InChI string: InChI=1/C29H26ClF2N3O3/c30-22-12-24(31)23(25(32)13-22)14-33-29(38)26-16-35-15-21(9-10-27(35)34-26)20-7-5-19(6-8-20)18-3-1-17(2-4-18)11-28(36)37/h5-10,12-13,15-18H,1-4,11,14H2,(H,33,38)(H,36,37)/t17-,18?

SMILES: OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cc(Cl)cc1F

InChI Key: InChIKey=IWNBKDWSDPNGCE-FNGKDXACNA-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 = 209554   
Target
(Institution)
LigandTarget
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
pHTemp
°C
Diacylglycerol O-acyltransferase 1


(Mus musculus (mouse))
BDBM209554
PNG
(US9271969, 42)
Show SMILES OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cc(Cl)cc1F
Show InChI InChI=1/C29H26ClF2N3O3/c30-22-12-24(31)23(25(32)13-22)14-33-29(38)26-16-35-15-21(9-10-27(35)34-26)20-7-5-19(6-8-20)18-3-1-17(2-4-18)11-28(36)37/h5-10,12-13,15-18H,1-4,11,14H2,(H,33,38)(H,36,37)/t17-,18?
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
US Patent
n/an/a<10n/an/an/an/an/an/a



KAINOS MEDICINE, INC.

US Patent


Assay Description
 Assay buffer [20 mM HEPES (pH 7.4), 100 mM MgCl2 and 0.04% bovine serum albumin (BSA)] containing 500 uM of enzyme substrate (didecanoyl glycerol) ...


US Patent US9271969 (2016)

More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 1


(Homo sapiens (human))
BDBM209554
PNG
(US9271969, 42)
Show SMILES OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cc(Cl)cc1F
Show InChI InChI=1/C29H26ClF2N3O3/c30-22-12-24(31)23(25(32)13-22)14-33-29(38)26-16-35-15-21(9-10-27(35)34-26)20-7-5-19(6-8-20)18-3-1-17(2-4-18)11-28(36)37/h5-10,12-13,15-18H,1-4,11,14H2,(H,33,38)(H,36,37)/t17-,18?
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
US Patent
n/an/a<10n/an/an/an/an/an/a



KAINOS MEDICINE, INC.

US Patent


Assay Description
 Assay buffer [20 mM HEPES (pH 7.4), 100 mM MgCl2 and 0.04% bovine serum albumin (BSA)] containing 500 uM of enzyme substrate (didecanoyl glycerol) ...


US Patent US9271969 (2016)

More data for this
Ligand-Target Pair