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BDBM50197129 CHEMBL387309::N-[1-[(2-fluoro-4-methoxybenzyl)methyl]piperidin-4-yl]-7-fluoro-4-oxo-4H-chromene-2-carboxamide

SMILES: COc1ccc(CN2CCC(CC2)NC(=O)c2cc(=O)c3ccc(F)cc3o2)c(F)c1

InChI Key: InChIKey=RASPHJGGIPBIMT-UHFFFAOYSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50197129   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50197129
PNG
(CHEMBL387309 | N-[1-[(2-fluoro-4-methoxybenzyl)met...)
Show SMILES COc1ccc(CN2CCC(CC2)NC(=O)c2cc(=O)c3ccc(F)cc3o2)c(F)c1
Show InChI InChI=1S/C23H22F2N2O4/c1-30-17-4-2-14(19(25)11-17)13-27-8-6-16(7-9-27)26-23(29)22-12-20(28)18-5-3-15(24)10-21(18)31-22/h2-5,10-12,16H,6-9,13H2,1H3,(H,26,29)
PDB
MMDB

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UniProtKB/SwissProt

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GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14.7n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from hERG


J Med Chem 49: 6569-84 (2006)


Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (Human))
BDBM50197129
PNG
(CHEMBL387309 | N-[1-[(2-fluoro-4-methoxybenzyl)met...)
Show SMILES COc1ccc(CN2CCC(CC2)NC(=O)c2cc(=O)c3ccc(F)cc3o2)c(F)c1
Show InChI InChI=1S/C23H22F2N2O4/c1-30-17-4-2-14(19(25)11-17)13-27-8-6-16(7-9-27)26-23(29)22-12-20(28)18-5-3-15(24)10-21(18)31-22/h2-5,10-12,16H,6-9,13H2,1H3,(H,26,29)
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 411n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at MCHr1 assessed as inhibition of MCH-mediated calcium ion release in intact IMR32 cells by FLIPR assay


J Med Chem 49: 6569-84 (2006)


Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (Human))
BDBM50197129
PNG
(CHEMBL387309 | N-[1-[(2-fluoro-4-methoxybenzyl)met...)
Show SMILES COc1ccc(CN2CCC(CC2)NC(=O)c2cc(=O)c3ccc(F)cc3o2)c(F)c1
Show InChI InChI=1S/C23H22F2N2O4/c1-30-17-4-2-14(19(25)11-17)13-27-8-6-16(7-9-27)26-23(29)22-12-20(28)18-5-3-15(24)10-21(18)31-22/h2-5,10-12,16H,6-9,13H2,1H3,(H,26,29)
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KEGG

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 53n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from MCHr1 expressed in IMR32 cells


J Med Chem 49: 6569-84 (2006)


Article DOI: 10.1021/jm060683e
BindingDB Entry DOI: 10.7270/Q2NG4Q7P
More data for this
Ligand-Target Pair