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BDBM50130083 2,3,4,5-Tetrahydro-1H-[1,4]diazepino[1,7-a]indole-11-carbaldehyde::CHEMBL310473

SMILES: O=Cc1c2CCNCCn2c2ccccc12

InChI Key: InChIKey=OFYVZJDMJKZFCI-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 = 50130083   
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
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50130083
PNG
(2,3,4,5-Tetrahydro-1H-[1,4]diazepino[1,7-a]indole-...)
Show SMILES O=Cc1c2CCNCCn2c2ccccc12
Show InChI InChI=1S/C13H14N2O/c16-9-11-10-3-1-2-4-12(10)15-8-7-14-6-5-13(11)15/h1-4,9,14H,5-8H2
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CHEMBL
PC cid
PC sid
UniChem

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Similars

PubMed
12n/an/an/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2C receptor using [125I]-DOI radioligand.


Bioorg Med Chem Lett 13: 2369-72 (2003)


BindingDB Entry DOI: 10.7270/Q2B857GJ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50130083
PNG
(2,3,4,5-Tetrahydro-1H-[1,4]diazepino[1,7-a]indole-...)
Show SMILES O=Cc1c2CCNCCn2c2ccccc12
Show InChI InChI=1S/C13H14N2O/c16-9-11-10-3-1-2-4-12(10)15-8-7-14-6-5-13(11)15/h1-4,9,14H,5-8H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
29n/an/an/an/an/an/an/an/a



Pharmacia Corporation

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2A receptor using [125I]-DOI radioligand.


Bioorg Med Chem Lett 13: 2369-72 (2003)


BindingDB Entry DOI: 10.7270/Q2B857GJ
More data for this
Ligand-Target Pair