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4 similar compounds to monomer 50284042

Compile data set for download or QSAR
Wt: 444.5
BDBM50284039
Wt: 460.5
BDBM50284040
Wt: 460.5
BDBM50284041
Wt: 430.5
BDBM50284043

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50284039,50284040,50284041,50284043   
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
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50284039
PNG
(2-(1-{2-[(5-Piperidin-1-ylmethyl-furan-2-ylmethyl)...)
Show SMILES Cc1cccc(c1)N1CCN(CCNCc2ccc(CN3CCCCC3)o2)C1=C(C#N)C#N
Show InChI InChI=1S/C26H32N6O/c1-21-6-5-7-23(16-21)32-15-14-31(26(32)22(17-27)18-28)13-10-29-19-24-8-9-25(33-24)20-30-11-3-2-4-12-30/h5-9,16,29H,2-4,10-15,19-20H2,1H3
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Article
n/an/a 13n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against acetylcholinesterase(AChE) from rat brain was determined


Bioorg Med Chem Lett 4: 615-618 (1994)


Article DOI: 10.1016/S0960-894X(01)80165-7
BindingDB Entry DOI: 10.7270/Q2FN1659
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50284043
PNG
(2-(1-Phenyl-3-{2-[(5-piperidin-1-ylmethyl-furan-2-...)
Show SMILES N#CC(C#N)=C1N(CCNCc2ccc(CN3CCCCC3)o2)CCN1c1ccccc1
Show InChI InChI=1S/C25H30N6O/c26-17-21(18-27)25-30(15-16-31(25)22-7-3-1-4-8-22)14-11-28-19-23-9-10-24(32-23)20-29-12-5-2-6-13-29/h1,3-4,7-10,28H,2,5-6,11-16,19-20H2
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Article
n/an/a 14n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against acetylcholinesterase(AChE) from rat brain was determined


Bioorg Med Chem Lett 4: 615-618 (1994)


Article DOI: 10.1016/S0960-894X(01)80165-7
BindingDB Entry DOI: 10.7270/Q2FN1659
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50284041
PNG
(2-(1-(3-Methoxy-phenyl)-3-{2-[(5-piperidin-1-ylmet...)
Show SMILES COc1cccc(c1)N1CCN(CCNCc2ccc(CN3CCCCC3)o2)C1=C(C#N)C#N
Show InChI InChI=1S/C26H32N6O2/c1-33-23-7-5-6-22(16-23)32-15-14-31(26(32)21(17-27)18-28)13-10-29-19-24-8-9-25(34-24)20-30-11-3-2-4-12-30/h5-9,16,29H,2-4,10-15,19-20H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 14n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against acetylcholinesterase(AChE) from rat brain was determined


Bioorg Med Chem Lett 4: 615-618 (1994)


Article DOI: 10.1016/S0960-894X(01)80165-7
BindingDB Entry DOI: 10.7270/Q2FN1659
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50284040
PNG
(2-(1-(4-Methoxy-phenyl)-3-{2-[(5-piperidin-1-ylmet...)
Show SMILES COc1ccc(cc1)N1CCN(CCNCc2ccc(CN3CCCCC3)o2)C1=C(C#N)C#N
Show InChI InChI=1S/C26H32N6O2/c1-33-23-7-5-22(6-8-23)32-16-15-31(26(32)21(17-27)18-28)14-11-29-19-24-9-10-25(34-24)20-30-12-3-2-4-13-30/h5-10,29H,2-4,11-16,19-20H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 19n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against acetylcholinesterase(AChE) from rat brain was determined


Bioorg Med Chem Lett 4: 615-618 (1994)


Article DOI: 10.1016/S0960-894X(01)80165-7
BindingDB Entry DOI: 10.7270/Q2FN1659
More data for this
Ligand-Target Pair