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SMILES: Fc1cc(OCCNCCCCc2ccc(cc2)C#N)c2OCCC(=O)c2c1

InChI Key: InChIKey=XTSRSIPANVDHSS-UHFFFAOYSA-N

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 = 50065579   
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
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50065579
PNG
(4-{4-[2-(6-Fluoro-4-oxo-chroman-8-yloxy)-ethylamin...)
Show SMILES Fc1cc(OCCNCCCCc2ccc(cc2)C#N)c2OCCC(=O)c2c1
Show InChI InChI=1S/C22H23FN2O3/c23-18-13-19-20(26)8-11-28-22(19)21(14-18)27-12-10-25-9-2-1-3-16-4-6-17(15-24)7-5-16/h4-7,13-14,25H,1-3,8-12H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Company, Ltd.

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 1A receptor on rat hippocampus using [3H]-8-OH-DPAT as radioligand.


J Med Chem 41: 2765-78 (1998)


Article DOI: 10.1021/jm9707840
BindingDB Entry DOI: 10.7270/Q2K073CQ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50065579
PNG
(4-{4-[2-(6-Fluoro-4-oxo-chroman-8-yloxy)-ethylamin...)
Show SMILES Fc1cc(OCCNCCCCc2ccc(cc2)C#N)c2OCCC(=O)c2c1
Show InChI InChI=1S/C22H23FN2O3/c23-18-13-19-20(26)8-11-28-22(19)21(14-18)27-12-10-25-9-2-1-3-16-4-6-17(15-24)7-5-16/h4-7,13-14,25H,1-3,8-12H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
70.4n/an/an/an/an/an/an/an/a



Yamanouchi Pharmaceutical Company, Ltd.

Curated by ChEMBL


Assay Description
Binding affinity against dopamine receptor D2 on rat striatum using [3H]-spiperone as radioligand.


J Med Chem 41: 2765-78 (1998)


Article DOI: 10.1021/jm9707840
BindingDB Entry DOI: 10.7270/Q2K073CQ
More data for this
Ligand-Target Pair