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BDBM155943 US9018213, 14

SMILES: Clc1c(OCCCCN2CCN(CC2)c2nsc3ccccc23)ccc2c3CCCc3c(=O)oc12

InChI Key: InChIKey=QTBDNKYGSAPFRG-UHFFFAOYSA-N

Data: 2 IC50

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 = 155943   
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))
BDBM155943
PNG
(US9018213, 14)
Show SMILES Clc1c(OCCCCN2CCN(CC2)c2nsc3ccccc23)ccc2c3CCCc3c(=O)oc12
Show InChI InChI=1S/C27H28ClN3O3S/c28-24-22(11-10-19-18-7-5-8-20(18)27(32)34-25(19)24)33-17-4-3-12-30-13-15-31(16-14-30)26-21-6-1-2-9-23(21)35-29-26/h1-2,6,9-11H,3-5,7-8,12-17H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.49E+3n/an/an/an/an/an/a



Huazhong University of Science & Technology; NHWA Pharma. Corporation

US Patent


Assay Description
(1) The prepared membrane was first applied with appropriate amount of homogenized liquid, and homogenizer was used for evenly dispersing. 15 tubes w...


US Patent US9018213 (2015)


BindingDB Entry DOI: 10.7270/Q27M06N0
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Rattus norvegicus (Rat))
BDBM155943
PNG
(US9018213, 14)
Show SMILES Clc1c(OCCCCN2CCN(CC2)c2nsc3ccccc23)ccc2c3CCCc3c(=O)oc12
Show InChI InChI=1S/C27H28ClN3O3S/c28-24-22(11-10-19-18-7-5-8-20(18)27(32)34-25(19)24)33-17-4-3-12-30-13-15-31(16-14-30)26-21-6-1-2-9-23(21)35-29-26/h1-2,6,9-11H,3-5,7-8,12-17H2
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 15.1n/an/an/an/a7.4n/a



Huazhong University of Science & Technology; NHWA Pharma. Corporation

US Patent


Assay Description
Competitive binding test for receptors: 20 μl of each of the test compounds and 20 μl of the radioactive ligand together with 160 μl o...


US Patent US9018213 (2015)


BindingDB Entry DOI: 10.7270/Q27M06N0
More data for this
Ligand-Target Pair