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BDBM50098533 2-Benzo[1,2-b;4,5-b']difuran-4-yl-1-methyl-ethyl-ammonium; chloride::CHEMBL6871

SMILES: C[C@@H]([NH3+])Cc1c2ccoc2cc2ccoc12

InChI Key: InChIKey=RZXKDUYUWHJRCH-MRVPVSSYSA-O

Data: 2 KI  1 EC50

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 3 hits for monomerid = 50098533   
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
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50098533
PNG
(2-Benzo[1,2-b;4,5-b']difuran-4-yl-1-methyl-ethyl-a...)
Show SMILES C[C@@H]([NH3+])Cc1c2ccoc2cc2ccoc12
Show InChI InChI=1S/C13H13NO2/c1-8(14)6-11-10-3-5-15-12(10)7-9-2-4-16-13(9)11/h2-5,7-8H,6,14H2,1H3/p+1/t8-/m1/s1
KEGG

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
0.790n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity at cloned rat 5-hydroxytryptamine 2C receptor using [3H]-DOI as radioligand


J Med Chem 44: 1003-10 (2001)


BindingDB Entry DOI: 10.7270/Q27P8XND
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50098533
PNG
(2-Benzo[1,2-b;4,5-b']difuran-4-yl-1-methyl-ethyl-a...)
Show SMILES C[C@@H]([NH3+])Cc1c2ccoc2cc2ccoc12
Show InChI InChI=1S/C13H13NO2/c1-8(14)6-11-10-3-5-15-12(10)7-9-2-4-16-13(9)11/h2-5,7-8H,6,14H2,1H3/p+1/t8-/m1/s1
PDB

Reactome pathway
KEGG

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.5n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity at cloned rat 5-hydroxytryptamine 2A receptor using [3H]-DOB as radioligand


J Med Chem 44: 1003-10 (2001)


BindingDB Entry DOI: 10.7270/Q27P8XND
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50098533
PNG
(2-Benzo[1,2-b;4,5-b']difuran-4-yl-1-methyl-ethyl-a...)
Show SMILES C[C@@H]([NH3+])Cc1c2ccoc2cc2ccoc12
Show InChI InChI=1S/C13H13NO2/c1-8(14)6-11-10-3-5-15-12(10)7-9-2-4-16-13(9)11/h2-5,7-8H,6,14H2,1H3/p+1/t8-/m1/s1
PDB

Reactome pathway
KEGG

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 590n/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Ability to stimulate phosphoinositide hydrolysis in NIH3T3 cells expressing the 5-hydroxytryptamine 2A receptor


J Med Chem 44: 1003-10 (2001)


BindingDB Entry DOI: 10.7270/Q27P8XND
More data for this
Ligand-Target Pair