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SMILES: CCCCCCc1[nH]c2ccc3OC4N(CCc5cc(OC)ccc45)Cc3c2c1C(=O)OCC

InChI Key: InChIKey=PUYDWHDEVFRQHJ-UHFFFAOYSA-N

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 5 hits for monomerid = 50473812   
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
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50473812
PNG
(CHEMBL105160)
Show SMILES CCCCCCc1[nH]c2ccc3OC4N(CCc5cc(OC)ccc45)Cc3c2c1C(=O)OCC
Show InChI InChI=1S/C28H34N2O4/c1-4-6-7-8-9-22-26(28(31)33-5-2)25-21-17-30-15-14-18-16-19(32-3)10-11-20(18)27(30)34-24(21)13-12-23(25)29-22/h10-13,16,27,29H,4-9,14-15,17H2,1-3H3
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14n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]NMS binding to human muscarinic acetylcholine receptor M4 in transfected CHO cells.


J Med Chem 45: 3094-102 (2002)


Article DOI: 10.1021/jm011116o
BindingDB Entry DOI: 10.7270/Q2BZ68S8
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50473812
PNG
(CHEMBL105160)
Show SMILES CCCCCCc1[nH]c2ccc3OC4N(CCc5cc(OC)ccc45)Cc3c2c1C(=O)OCC
Show InChI InChI=1S/C28H34N2O4/c1-4-6-7-8-9-22-26(28(31)33-5-2)25-21-17-30-15-14-18-16-19(32-3)10-11-20(18)27(30)34-24(21)13-12-23(25)29-22/h10-13,16,27,29H,4-9,14-15,17H2,1-3H3
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282n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]NMS binding to human muscarinic acetylcholine receptor M3 in transfected CHO cells.


J Med Chem 45: 3094-102 (2002)


Article DOI: 10.1021/jm011116o
BindingDB Entry DOI: 10.7270/Q2BZ68S8
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50473812
PNG
(CHEMBL105160)
Show SMILES CCCCCCc1[nH]c2ccc3OC4N(CCc5cc(OC)ccc45)Cc3c2c1C(=O)OCC
Show InChI InChI=1S/C28H34N2O4/c1-4-6-7-8-9-22-26(28(31)33-5-2)25-21-17-30-15-14-18-16-19(32-3)10-11-20(18)27(30)34-24(21)13-12-23(25)29-22/h10-13,16,27,29H,4-9,14-15,17H2,1-3H3
UniProtKB/SwissProt

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PubMed
3.09E+3n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]NMS binding to human muscarinic acetylcholine receptor M1 in transfected CHO cells.


J Med Chem 45: 3094-102 (2002)


Article DOI: 10.1021/jm011116o
BindingDB Entry DOI: 10.7270/Q2BZ68S8
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50473812
PNG
(CHEMBL105160)
Show SMILES CCCCCCc1[nH]c2ccc3OC4N(CCc5cc(OC)ccc45)Cc3c2c1C(=O)OCC
Show InChI InChI=1S/C28H34N2O4/c1-4-6-7-8-9-22-26(28(31)33-5-2)25-21-17-30-15-14-18-16-19(32-3)10-11-20(18)27(30)34-24(21)13-12-23(25)29-22/h10-13,16,27,29H,4-9,14-15,17H2,1-3H3
PDB

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antibodypedia
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UniChem
Article
PubMed
4.57E+3n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]-NMS binding to human muscarinic acetylcholine receptor M2 in transfected CHO cells.


J Med Chem 45: 3094-102 (2002)


Article DOI: 10.1021/jm011116o
BindingDB Entry DOI: 10.7270/Q2BZ68S8
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M5


(Homo sapiens (Human))
BDBM50473812
PNG
(CHEMBL105160)
Show SMILES CCCCCCc1[nH]c2ccc3OC4N(CCc5cc(OC)ccc45)Cc3c2c1C(=O)OCC
Show InChI InChI=1S/C28H34N2O4/c1-4-6-7-8-9-22-26(28(31)33-5-2)25-21-17-30-15-14-18-16-19(32-3)10-11-20(18)27(30)34-24(21)13-12-23(25)29-22/h10-13,16,27,29H,4-9,14-15,17H2,1-3H3
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>2.82E+4n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]NMS binding to human muscarinic acetylcholine receptor M5 in transfected CHO cells.


J Med Chem 45: 3094-102 (2002)


Article DOI: 10.1021/jm011116o
BindingDB Entry DOI: 10.7270/Q2BZ68S8
More data for this
Ligand-Target Pair