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BDBM50034076 CHEMBL14393::N-(5-Acetyl-2-{3-[4-(6-fluoro-benzo[d]isoxazol-3-yl)-piperidin-1-yl]-propoxy}-phenyl)-acetamide

SMILES: CC(=O)Nc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O

InChI Key: InChIKey=NXTZIWVLIMODNI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50034076   
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))		BDBM50034076
PNG
(CHEMBL14393 | N-(5-Acetyl-2-{3-[4-(6-fluoro-benzo[...)
Show SMILES CC(=O)Nc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O
Show InChI InChI=1S/C25H28FN3O4/c1-16(30)19-4-7-23(22(14-19)27-17(2)31)32-13-3-10-29-11-8-18(9-12-29)25-21-6-5-20(26)15-24(21)33-28-25/h4-7,14-15,18H,3,8-13H2,1-2H3,(H,27,31)
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n/an/a 107n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.

J Med Chem 38: 1119-31 (1995)


BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair