BindingDB logo
myBDB logout

BDBM321266 N-[3-(2-(N-methylbenzyl)amino)ethyl]-4-chlorobenzamide::US10179761, Compound 3.1.9

SMILES: CNc1ccccc1CNCCCNC(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=SMBAOURHXAGUDO-UHFFFAOYSA-N

Data: 2 KI

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 = 321266   
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


(Homo sapiens (Human))
BDBM321266
PNG
(N-[3-(2-(N-methylbenzyl)amino)ethyl]-4-chlorobenza...)
Show SMILES CNc1ccccc1CNCCCNC(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C18H22ClN3O/c1-20-17-6-3-2-5-15(17)13-21-11-4-12-22-18(23)14-7-9-16(19)10-8-14/h2-3,5-10,20-21H,4,11-13H2,1H3,(H,22,23)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
3.60n/an/an/an/an/an/an/an/a



UNIVERSITE DE LILLE 2 DROIT ET SANTE; CENTRE HOSPITALIER REGIONAL ET UNIVERSITAIRE DE LILLE (CHRU)

US Patent


Assay Description
The σ binding assays were performed according to Ganapathy et al. (Ganapathy, M. E.; Prasad, P. D.; Huang, W.; Seth, P.; Leibach, F. H.; Ganapat...


US Patent US10179761 (2019)


BindingDB Entry DOI: 10.7270/Q2NV9MBG
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Homo sapiens (Human))
BDBM321266
PNG
(N-[3-(2-(N-methylbenzyl)amino)ethyl]-4-chlorobenza...)
Show SMILES CNc1ccccc1CNCCCNC(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C18H22ClN3O/c1-20-17-6-3-2-5-15(17)13-21-11-4-12-22-18(23)14-7-9-16(19)10-8-14/h2-3,5-10,20-21H,4,11-13H2,1H3,(H,22,23)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
850n/an/an/an/an/an/an/an/a



UNIVERSITE DE LILLE 2 DROIT ET SANTE; CENTRE HOSPITALIER REGIONAL ET UNIVERSITAIRE DE LILLE (CHRU)

US Patent


Assay Description
The σ binding assays were performed according to Ganapathy et al. (Ganapathy, M. E.; Prasad, P. D.; Huang, W.; Seth, P.; Leibach, F. H.; Ganapat...


US Patent US10179761 (2019)


BindingDB Entry DOI: 10.7270/Q2NV9MBG
More data for this
Ligand-Target Pair