BindingDB logo
myBDB logout

BDBM65863 3-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-1H-indole::3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-1H-indole::3-[[4-(4-fluorophenyl)piperazino]methyl]-1H-indole::3-{[4-(4-fluorophenyl)piperazino]methyl}-1H-indole::MLS000860405::SMR000458489::cid_2812866

SMILES: Fc1ccc(cc1)N1CCN(Cc2c[nH]c3ccccc23)CC1

InChI Key: InChIKey=PCLWAFVRAWUFRN-UHFFFAOYSA-N

Data: 1 KI  1 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 = 65863   
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
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM65863
PNG
(3-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-1H-in...)
Show SMILES Fc1ccc(cc1)N1CCN(Cc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C19H20FN3/c20-16-5-7-17(8-6-16)23-11-9-22(10-12-23)14-15-13-21-19-4-2-1-3-18(15)19/h1-8,13,21H,9-12,14H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
3.64E+3 -7.71n/an/an/an/an/a7.437



Yeditepe University



Assay Description
The test was performed with the radioligand [3H]-(+)-pentazocine (42.5 Ci/mmol) from Perkin Elmer.


Chem Biol Drug Des 78: 869-75 (2011)


Article DOI: 10.1111/j.1747-0285.2011.01215.x
BindingDB Entry DOI: 10.7270/Q2513WQT
More data for this
Ligand-Target Pair
inward rectifier potassium channel 2


(Mus musculus)
BDBM65863
PNG
(3-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-1H-in...)
Show SMILES Fc1ccc(cc1)N1CCN(Cc2c[nH]c3ccccc23)CC1
Show InChI InChI=1S/C19H20FN3/c20-16-5-7-17(8-6-16)23-11-9-22(10-12-23)14-15-13-21-19-4-2-1-3-18(15)19/h1-8,13,21H,9-12,14H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.07E+4n/an/an/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
Data Source: Johns Hopkins Ion Channel Center (JHICC) BioAssay Type: Confirmatory, Confirmatory Screening, Multiple Concentration Activity Observed. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q23R0R98
More data for this
Ligand-Target Pair