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BDBM50032565 (4-Methyl-naphthalen-1-yl)-[1-(2-morpholin-4-yl-ethyl)-1H-indol-3-yl]-methanone::CHEMBL80214

SMILES: Cc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12

InChI Key: InChIKey=ICKWPPYMDARCKJ-UHFFFAOYSA-N

Data: 3 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50032565   
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
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50032565
PNG
((4-Methyl-naphthalen-1-yl)-[1-(2-morpholin-4-yl-et...)
Show SMILES Cc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C26H26N2O2/c1-19-10-11-23(21-7-3-2-6-20(19)21)26(29)24-18-28(25-9-5-4-8-22(24)25)13-12-27-14-16-30-17-15-27/h2-11,18H,12-17H2,1H3
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Article
PubMed
20n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor


J Med Chem 59: 7525-43 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00516
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032565
PNG
((4-Methyl-naphthalen-1-yl)-[1-(2-morpholin-4-yl-et...)
Show SMILES Cc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C26H26N2O2/c1-19-10-11-23(21-7-3-2-6-20(19)21)26(29)24-18-28(25-9-5-4-8-22(24)25)13-12-27-14-16-30-17-15-27/h2-11,18H,12-17H2,1H3
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4.47E+8n/an/an/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Cannabinoid receptor 1 binding affinity by measuring its ability to displace [3H]WIN-55212-2 in rat forebrain membranes


J Med Chem 41: 4521-32 (1998)


Article DOI: 10.1021/jm980305c
BindingDB Entry DOI: 10.7270/Q2XD14F0
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032565
PNG
((4-Methyl-naphthalen-1-yl)-[1-(2-morpholin-4-yl-et...)
Show SMILES Cc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C26H26N2O2/c1-19-10-11-23(21-7-3-2-6-20(19)21)26(29)24-18-28(25-9-5-4-8-22(24)25)13-12-27-14-16-30-17-15-27/h2-11,18H,12-17H2,1H3
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4.47E+8n/an/an/an/an/an/an/an/a



Institute of Bioorganic & Petroleum Chemistry

Curated by ChEMBL


Assay Description
Binding affinity at cannabinoid receptor 1 using rat brain membranes


J Med Chem 44: 2411-20 (2001)


Article DOI: 10.1021/jm010858e
BindingDB Entry DOI: 10.7270/Q2GT5QXX
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50032565
PNG
((4-Methyl-naphthalen-1-yl)-[1-(2-morpholin-4-yl-et...)
Show SMILES Cc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C26H26N2O2/c1-19-10-11-23(21-7-3-2-6-20(19)21)26(29)24-18-28(25-9-5-4-8-22(24)25)13-12-27-14-16-30-17-15-27/h2-11,18H,12-17H2,1H3
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n/an/a 2.80n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair