BindingDB logo
myBDB logout

null

SMILES: OC1CN(CCc2cc(O)ccc12)[C@H]1CC[C@@H](CC1)c1ccccc1

InChI Key: InChIKey=GUYOIYKANZNIKE-NRCGHCQOSA-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 = 50331318   
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
Glutamate receptor ionotropic, NMDA 1/2B


(Homo sapiens (Human))
BDBM50331318
PNG
((+/-)-trans-3-(4-Phenylcyclohexyl)-2,3,4,5-tetrahy...)
Show SMILES OC1CN(CCc2cc(O)ccc12)[C@H]1CC[C@@H](CC1)c1ccccc1 |r,wU:16.21,wD:13.14,(16.06,-12.53,;16.44,-13.97,;17.95,-14.23,;18.71,-15.64,;18.07,-17.08,;16.55,-17.44,;15.27,-16.44,;13.98,-17.18,;12.68,-16.43,;11.4,-17.19,;12.68,-14.96,;13.96,-14.21,;15.26,-14.94,;20.32,-15.64,;21.12,-17.03,;22.72,-17.03,;23.53,-15.65,;22.72,-14.25,;21.11,-14.25,;25.06,-15.65,;25.83,-16.99,;27.37,-17,;28.14,-15.66,;27.37,-14.32,;25.83,-14.32,)|
Show InChI InChI=1S/C22H27NO2/c24-20-10-11-21-18(14-20)12-13-23(15-22(21)25)19-8-6-17(7-9-19)16-4-2-1-3-5-16/h1-5,10-11,14,17,19,22,24-25H,6-9,12-13,15H2/t17-,19-,22?
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9n/an/an/an/an/an/an/an/a



Institut für Pharmazeutische und Medizinische Chemie der Westfälischen Wilhelms-Universität Münster

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from human recombinant NR1-1a/NR2B receptor expressed in mouse L(tk-) cells after 120 mins by scintillation counting


Bioorg Med Chem 18: 8005-15 (2010)


Article DOI: 10.1016/j.bmc.2010.09.026
BindingDB Entry DOI: 10.7270/Q28W3DJB
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50331318
PNG
((+/-)-trans-3-(4-Phenylcyclohexyl)-2,3,4,5-tetrahy...)
Show SMILES OC1CN(CCc2cc(O)ccc12)[C@H]1CC[C@@H](CC1)c1ccccc1 |r,wU:16.21,wD:13.14,(16.06,-12.53,;16.44,-13.97,;17.95,-14.23,;18.71,-15.64,;18.07,-17.08,;16.55,-17.44,;15.27,-16.44,;13.98,-17.18,;12.68,-16.43,;11.4,-17.19,;12.68,-14.96,;13.96,-14.21,;15.26,-14.94,;20.32,-15.64,;21.12,-17.03,;22.72,-17.03,;23.53,-15.65,;22.72,-14.25,;21.11,-14.25,;25.06,-15.65,;25.83,-16.99,;27.37,-17,;28.14,-15.66,;27.37,-14.32,;25.83,-14.32,)|
Show InChI InChI=1S/C22H27NO2/c24-20-10-11-21-18(14-20)12-13-23(15-22(21)25)19-8-6-17(7-9-19)16-4-2-1-3-5-16/h1-5,10-11,14,17,19,22,24-25H,6-9,12-13,15H2/t17-,19-,22?
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
200n/an/an/an/an/an/an/an/a



Institut für Pharmazeutische und Medizinische Chemie der Westfälischen Wilhelms-Universität Münster

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)-pentazocine from sigma1 receptor guinea pig brain after 180 mins scintillation counting


Bioorg Med Chem 18: 8005-15 (2010)


Article DOI: 10.1016/j.bmc.2010.09.026
BindingDB Entry DOI: 10.7270/Q28W3DJB
More data for this
Ligand-Target Pair