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BDBM81452 CAS_91533::Dimethindene::NSC_91533

SMILES: CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1

InChI Key: InChIKey=MVMQESMQSYOVGV-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 81452   
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
Histamine H1 receptor


(RAT)
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
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8n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Proc Natl Acad Sci U S A 75: 6290-4 (1978)


BindingDB Entry DOI: 10.7270/Q2FN14P6
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
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45n/an/an/an/an/an/an/an/a



University of Mainz

Curated by ChEMBL


Assay Description
Affinity for Muscarinic acetylcholine receptor M2 expressed in CHO cells by [3H]NMS displacement.


Bioorg Med Chem Lett 11: 1241-3 (2001)


Article DOI: 10.1016/s0960-894x(01)00186-x
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1 and M3


(Homo sapiens (Human))
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
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191n/an/an/an/an/an/an/an/a



University of Mainz

Curated by ChEMBL


Assay Description
Affinity for Muscarinic acetylcholine receptor M3 expressed in CHO cells by [3H]-NMS displacement.


Bioorg Med Chem Lett 11: 1241-3 (2001)


Article DOI: 10.1016/s0960-894x(01)00186-x
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
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PubMed
263n/an/an/an/an/an/an/an/a



University of Mainz

Curated by ChEMBL


Assay Description
Affinity for Muscarinic acetylcholine receptor M1 expressed in CHO cells by [3H]NMS displacement.


Bioorg Med Chem Lett 11: 1241-3 (2001)


Article DOI: 10.1016/s0960-894x(01)00186-x
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(HUMAN M3)
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
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407n/an/an/an/an/an/an/an/a



University of Mainz

Curated by ChEMBL


Assay Description
Affinity for Muscarinic acetylcholine receptor M4 expressed in CHO cells by [3H]NMS displacement.


Bioorg Med Chem Lett 11: 1241-3 (2001)


Article DOI: 10.1016/s0960-894x(01)00186-x
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M5 chimeric protein


(Homo sapiens)
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
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794n/an/an/an/an/an/an/an/a



University of Mainz

Curated by ChEMBL


Assay Description
Affinity for Muscarinic acetylcholine receptor M5 expressed in CHO cells by [3H]NMS displacement.


Bioorg Med Chem Lett 11: 1241-3 (2001)


Article DOI: 10.1016/s0960-894x(01)00186-x
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor and beta-3 adrenergic receptor


(Homo sapiens (Human))
BDBM81452
PNG
(CAS_91533 | Dimethindene | NSC_91533)
Show SMILES CC(C1=C(CCN(C)C)Cc2ccccc12)c1ccccn1
Show InChI InChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3
PDB
MMDB

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>1.00E+4n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Mol Pharmacol 12: 568-80 (1976)


BindingDB Entry DOI: 10.7270/Q2ZK5F5P
More data for this
Ligand-Target Pair