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BDBM269341 (R)-2-(4-(6-fluoronaphthalen-2-yl)-2-methylphenyl)-4,4-dimethyl-1-((1-(1-methylcyclopropanecarbonyl)pyrrolidin-3-yl)methyl)-1H-imidazol-5(4H)-one ::US9718813, Compound 86

SMILES: Cc1cc(ccc1C1=NC(C)(C)C(=O)N1C[C@@H]1CCN(C1)C(=O)C1(C)CC1)-c1ccc2cc(F)ccc2c1

InChI Key: InChIKey=DGGFOWOZOIDBCJ-OAQYLSRUSA-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 = 269341   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
1,5-anhydro-D-fructose reductase


(Homo sapiens (human))
BDBM269341
PNG
((R)-2-(4-(6-fluoronaphthalen-2-yl)-2-methylphenyl)...)
Show SMILES Cc1cc(ccc1C1=NC(C)(C)C(=O)N1C[C@@H]1CCN(C1)C(=O)C1(C)CC1)-c1ccc2cc(F)ccc2c1
Show InChI InChI=1S/C32H34FN3O2/c1-20-15-22(23-5-6-25-17-26(33)9-7-24(25)16-23)8-10-27(20)28-34-31(2,3)29(37)36(28)19-21-11-14-35(18-21)30(38)32(4)12-13-32/h5-10,15-17,21H,11-14,18-19H2,1-4H3/t21-/m1/s1
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 25.1n/an/an/an/a7.525



Janssen Pharmaceutica NV

US Patent


Assay Description
10 μL assay buffer (100 mM KH2PO4 pH 7.5) was added to a 384-well clear plate (costar 3702). 0.3 μL compound (at concentrations of 30 μ...


US Patent US9718813 (2017)

More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))
BDBM269341
PNG
((R)-2-(4-(6-fluoronaphthalen-2-yl)-2-methylphenyl)...)
Show SMILES Cc1cc(ccc1C1=NC(C)(C)C(=O)N1C[C@@H]1CCN(C1)C(=O)C1(C)CC1)-c1ccc2cc(F)ccc2c1
Show InChI InChI=1S/C32H34FN3O2/c1-20-15-22(23-5-6-25-17-26(33)9-7-24(25)16-23)8-10-27(20)28-34-31(2,3)29(37)36(28)19-21-11-14-35(18-21)30(38)32(4)12-13-32/h5-10,15-17,21H,11-14,18-19H2,1-4H3/t21-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 42.7n/an/an/an/a7.525



Janssen Pharmaceutica NV

US Patent


Assay Description
In this assay, inhibition of FASN activity is measured using 3H-acetyl-CoA and malonyl-CoA as substrates. 3H-Acetyl CoA is converted to 3H-palmitate ...


US Patent US9718813 (2017)

More data for this
Ligand-Target Pair