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BDBM322298 6-cyclopropyl-N-(1''-azaspiro[cyclopropane-1,2''-bicyclo[2.2.2]octan]-3''-yl)benzo[b]thiophene-2-carboxamide::US10183938, Compound 71a::US10183938, Compound 71b

SMILES: O=C(NC1C2CCN(CC2)C11CC1)c1cc2ccc(cc2s1)C1CC1

InChI Key: InChIKey=MGTLCRSMMGOQIY-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 322298   
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
Neuronal acetylcholine receptor protein alpha-7 subunit


(Homo sapiens (Human))
BDBM322298
PNG
(6-cyclopropyl-N-(1''-azaspiro[cyclopropane-1,2''-b...)
Show SMILES O=C(NC1C2CCN(CC2)C11CC1)c1cc2ccc(cc2s1)C1CC1
Show InChI InChI=1S/C21H24N2OS/c24-20(22-19-14-5-9-23(10-6-14)21(19)7-8-21)18-12-16-4-3-15(13-1-2-13)11-17(16)25-18/h3-4,11-14,19H,1-2,5-10H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
210n/an/an/an/an/an/an/an/a



Axovant Sciences GmbH

US Patent


Assay Description
The ability of compounds to displace binding of radioactive ligands from human α7 nAChR was determined, as a measure of the affinity of the comp...


US Patent US10183938 (2019)


BindingDB Entry DOI: 10.7270/Q2VD71JR
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM322298
PNG
(6-cyclopropyl-N-(1''-azaspiro[cyclopropane-1,2''-b...)
Show SMILES O=C(NC1C2CCN(CC2)C11CC1)c1cc2ccc(cc2s1)C1CC1
Show InChI InChI=1S/C21H24N2OS/c24-20(22-19-14-5-9-23(10-6-14)21(19)7-8-21)18-12-16-4-3-15(13-1-2-13)11-17(16)25-18/h3-4,11-14,19H,1-2,5-10H2,(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
>1.00E+4n/an/an/an/an/an/an/an/a



Axovant Sciences GmbH

US Patent


Assay Description
[3H]BRL 43694 competition binding assay was performed under contract by Cerep Poitiers, France following the methods described in Hope, A. G et al., ...


US Patent US10183938 (2019)


BindingDB Entry DOI: 10.7270/Q2VD71JR
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-7 subunit


(Homo sapiens (Human))
BDBM322298
PNG
(6-cyclopropyl-N-(1''-azaspiro[cyclopropane-1,2''-b...)
Show SMILES O=C(NC1C2CCN(CC2)C11CC1)c1cc2ccc(cc2s1)C1CC1
Show InChI InChI=1S/C21H24N2OS/c24-20(22-19-14-5-9-23(10-6-14)21(19)7-8-21)18-12-16-4-3-15(13-1-2-13)11-17(16)25-18/h3-4,11-14,19H,1-2,5-10H2,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
>3.00E+4n/an/an/an/an/an/an/an/a



Axovant Sciences GmbH

US Patent


Assay Description
The ability of compounds to displace binding of radioactive ligands from human α7 nAChR was determined, as a measure of the affinity of the comp...


US Patent US10183938 (2019)


BindingDB Entry DOI: 10.7270/Q2VD71JR
More data for this
Ligand-Target Pair