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BDBM50291601 1-(4-Diisopropylamino-but-2-ynyl)-3,3-diphenyl-pyrrolidine-2,5-dione::CHEMBL368792

SMILES: CC(C)N(CC#CCN1C(=O)CC(C1=O)(c1ccccc1)c1ccccc1)C(C)C

InChI Key: InChIKey=KLGANUHFFONXJC-UHFFFAOYSA-N

Data: 2 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50291601   
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 M2


(RAT)
BDBM50291601
PNG
(1-(4-Diisopropylamino-but-2-ynyl)-3,3-diphenyl-pyr...)
Show SMILES CC(C)N(CC#CCN1C(=O)CC(C1=O)(c1ccccc1)c1ccccc1)C(C)C
Show InChI InChI=1S/C26H30N2O2/c1-20(2)27(21(3)4)17-11-12-18-28-24(29)19-26(25(28)30,22-13-7-5-8-14-22)23-15-9-6-10-16-23/h5-10,13-16,20-21H,17-19H2,1-4H3
PDB

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UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
440n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB (quinuclidinyl benzylate) from muscarinic M2 receptor of rat heart homogenates.


Bioorg Med Chem Lett 7: 979-984 (1997)


Article DOI: 10.1016/S0960-894X(97)00143-1
BindingDB Entry DOI: 10.7270/Q2N29XFM
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50291601
PNG
(1-(4-Diisopropylamino-but-2-ynyl)-3,3-diphenyl-pyr...)
Show SMILES CC(C)N(CC#CCN1C(=O)CC(C1=O)(c1ccccc1)c1ccccc1)C(C)C
Show InChI InChI=1S/C26H30N2O2/c1-20(2)27(21(3)4)17-11-12-18-28-24(29)19-26(25(28)30,22-13-7-5-8-14-22)23-15-9-6-10-16-23/h5-10,13-16,20-21H,17-19H2,1-4H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
530n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]pirenzepine from muscarinic M1 receptor of rat cortex homogenates.


Bioorg Med Chem Lett 7: 979-984 (1997)


Article DOI: 10.1016/S0960-894X(97)00143-1
BindingDB Entry DOI: 10.7270/Q2N29XFM
More data for this
Ligand-Target Pair