BDBM81768 BENZYLIC ACID::CAS_6581-06-2::NSC_5311391::Quinuclidinyl benzilate

SMILES c1ccc(cc1)C(c2ccccc2)(C(=O)O)O

InChI Key InChIKey=UKXSKSHDVLQNKG-UHFFFAOYSA-N

Data  20 KI

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 20 hits for monomerid = 81768   

TargetMuscarinic acetylcholine receptor M2(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0270nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M2(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0300nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M4(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0340nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M1(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0350nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M4(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0370nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M2(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0400nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2011
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M5(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0430nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M1(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0440nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M5(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0650nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M3(Human)
Mayo Foundation

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0800nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M3(Human)
Mayo Foundation

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.0880nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2011
Entry Details
PubMed
TargetMuscarinic acetylcholine receptor M2(Human)
Mayo Clinic

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.170nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/25/2012
Entry Details Article
PubMed
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.400nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2011
Entry Details Article
PubMed
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  0.5nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2012
Entry Details Article
PubMed
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  9.00E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/22/2011
Entry Details
PubMed
TargetD(2) dopamine receptor(Rat)
Vanderbilt University

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Rat)
Vanderbilt University

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Rat)
Vanderbilt University

Curated by PDSP Ki Database
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/2/2012
Entry Details Article
PubMed
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/22/2011
Entry Details
PubMed
TargetMandelate racemase(Pseudomonas putida (g-Proteobacteria))
Dalhousie University

Curated by ChEMBL
LigandPNGBDBM81768(BENZYLIC ACID | NSC_5311391 | CAS_6581-06-2 | Quin...)
Affinity DataKi:  7.00E+5nMAssay Description:Competitive inhibition of Pseudomonas putida mandelate racemaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2014
Entry Details Article
PubMedPDB3D3D Structure (crystal)