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BDBM50115118 CHEMBL3609357

SMILES: C(CN1Cc2ccccc2C1)CN1CCC(CC1)c1c[nH]c2ccccc12

InChI Key: InChIKey=AVXYZHOVWRYDSQ-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50115118   
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
Alpha adrenergic receptor 1A and 1B


(Rattus norvegicus (rat))
BDBM50115118
PNG
(CHEMBL3609357)
Show SMILES C(CN1Cc2ccccc2C1)CN1CCC(CC1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C24H29N3/c1-2-7-21-18-27(17-20(21)6-1)13-5-12-26-14-10-19(11-15-26)23-16-25-24-9-4-3-8-22(23)24/h1-4,6-9,16,19,25H,5,10-15,17-18H2
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.60n/an/an/an/an/an/an/an/a



Toray Industries, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1B adrenoceptor in rat liver membranes


Bioorg Med Chem Lett 25: 3921-3 (2015)


BindingDB Entry DOI: 10.7270/Q27M09Q4
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50115118
PNG
(CHEMBL3609357)
Show SMILES C(CN1Cc2ccccc2C1)CN1CCC(CC1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C24H29N3/c1-2-7-21-18-27(17-20(21)6-1)13-5-12-26-14-10-19(11-15-26)23-16-25-24-9-4-3-8-22(23)24/h1-4,6-9,16,19,25H,5,10-15,17-18H2
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
50n/an/an/an/an/an/an/an/a



Toray Industries, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1A adrenoceptor in rat submaxillary gland membrane


Bioorg Med Chem Lett 25: 3921-3 (2015)


BindingDB Entry DOI: 10.7270/Q27M09Q4
More data for this
Ligand-Target Pair