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BDBM50072823 7-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin-1-yl]-propoxy}-4-oxo-4H-chromene-3-carbaldehyde::CHEMBL149412

SMILES: Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc3c(c2)occ(C=O)c3=O)CC1

InChI Key: InChIKey=KXQSQOALQLSOII-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50072823   
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
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50072823
PNG
(7-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc3c(c2)occ(C=O)c3=O)CC1
Show InChI InChI=1S/C25H23FN2O5/c26-18-2-4-20-23(12-18)33-27-24(20)16-6-9-28(10-7-16)8-1-11-31-19-3-5-21-22(13-19)32-15-17(14-29)25(21)30/h2-5,12-16H,1,6-11H2
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 13.1n/an/an/an/an/an/a



Centro de Investigación Grupo Ferrer

Curated by ChEMBL


Assay Description
Inhibition of [3H]-methylspiperone binding to rat striatal membrane Dopamine receptor D2


J Med Chem 41: 5402-9 (1999)


Article DOI: 10.1021/jm9810396
BindingDB Entry DOI: 10.7270/Q2QC02N8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50072823
PNG
(7-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc3c(c2)occ(C=O)c3=O)CC1
Show InChI InChI=1S/C25H23FN2O5/c26-18-2-4-20-23(12-18)33-27-24(20)16-6-9-28(10-7-16)8-1-11-31-19-3-5-21-22(13-19)32-15-17(14-29)25(21)30/h2-5,12-16H,1,6-11H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.10n/an/an/an/an/an/a



Centro de Investigación Grupo Ferrer

Curated by ChEMBL


Assay Description
Inhibition of [3H]-ketanserin binding to rat frontal cortex membrane 5-hydroxytryptamine 2A receptor


J Med Chem 41: 5402-9 (1999)


Article DOI: 10.1021/jm9810396
BindingDB Entry DOI: 10.7270/Q2QC02N8
More data for this
Ligand-Target Pair