BindingDB logo
myBDB logout

5 similar compounds to monomer 50111353

Compile data set for download or QSAR
Wt: 544.7
BDBM50111329
Wt: 530.7
BDBM50111335
Wt: 516.6
BDBM50111336
Wt: 544.7
BDBM50111343
Wt: 530.7
BDBM50111351

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50111329,50111335,50111336,50111343,50111351   
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


(Homo sapiens (Human))
BDBM50111336
PNG
(CHEMBL11892 | {4-[1'-(Naphthalene-1-carbonyl)-[1,4...)
Show SMILES COC(=O)CSc1ccc(CC2CCN(CC2)C2CCN(CC2)C(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C31H36N2O3S/c1-36-30(34)22-37-27-11-9-23(10-12-27)21-24-13-17-32(18-14-24)26-15-19-33(20-16-26)31(35)29-8-4-6-25-5-2-3-7-28(25)29/h2-12,24,26H,13-22H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.700n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against muscarinic acetylcholine receptor M2 stably expressed in CHO-K1 cells using [3H]-QNB as radioligand.


Bioorg Med Chem Lett 12: 1087-91 (2002)


Article DOI: 10.1016/s0960-894x(02)00096-3
BindingDB Entry DOI: 10.7270/Q2MS3S2P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50111329
PNG
((6-Isopropoxy-naphthalen-1-yl)-[4-(4-isopropylsulf...)
Show SMILES CC(C)Oc1ccc2c(cccc2c1)C(=O)N1CCC(CC1)N1CCC(Cc2ccc(SC(C)C)cc2)CC1
Show InChI InChI=1S/C34H44N2O2S/c1-24(2)38-30-10-13-32-28(23-30)6-5-7-33(32)34(37)36-20-16-29(17-21-36)35-18-14-27(15-19-35)22-26-8-11-31(12-9-26)39-25(3)4/h5-13,23-25,27,29H,14-22H2,1-4H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.10n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against muscarinic acetylcholine receptor M2 stably expressed in CHO-K1 cells using [3H]-QNB as radioligand.


Bioorg Med Chem Lett 12: 1087-91 (2002)


Article DOI: 10.1016/s0960-894x(02)00096-3
BindingDB Entry DOI: 10.7270/Q2MS3S2P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50111335
PNG
((6-Ethoxy-naphthalen-1-yl)-[4-(4-isopropylsulfanyl...)
Show SMILES CCOc1ccc2c(cccc2c1)C(=O)N1CCC(CC1)N1CCC(Cc2ccc(SC(C)C)cc2)CC1
Show InChI InChI=1S/C33H42N2O2S/c1-4-37-29-10-13-31-27(23-29)6-5-7-32(31)33(36)35-20-16-28(17-21-35)34-18-14-26(15-19-34)22-25-8-11-30(12-9-25)38-24(2)3/h5-13,23-24,26,28H,4,14-22H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against muscarinic acetylcholine receptor M2 stably expressed in CHO-K1 cells using [3H]-QNB as radioligand.


Bioorg Med Chem Lett 12: 1087-91 (2002)


Article DOI: 10.1016/s0960-894x(02)00096-3
BindingDB Entry DOI: 10.7270/Q2MS3S2P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50111351
PNG
(CHEMBL11690 | {4-[1'-(Naphthalene-1-carbonyl)-[1,4...)
Show SMILES CCOC(=O)CSc1ccc(CC2CCN(CC2)C2CCN(CC2)C(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C32H38N2O3S/c1-2-37-31(35)23-38-28-12-10-24(11-13-28)22-25-14-18-33(19-15-25)27-16-20-34(21-17-27)32(36)30-9-5-7-26-6-3-4-8-29(26)30/h3-13,25,27H,2,14-23H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
40n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against muscarinic acetylcholine receptor M2 stably expressed in CHO-K1 cells using [3H]-QNB as radioligand.


Bioorg Med Chem Lett 12: 1087-91 (2002)


Article DOI: 10.1016/s0960-894x(02)00096-3
BindingDB Entry DOI: 10.7270/Q2MS3S2P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50111343
PNG
(CHEMBL12419 | {4-[1'-(Naphthalene-1-carbonyl)-[1,4...)
Show SMILES CC(C)OC(=O)CSc1ccc(CC2CCN(CC2)C2CCN(CC2)C(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C33H40N2O3S/c1-24(2)38-32(36)23-39-29-12-10-25(11-13-29)22-26-14-18-34(19-15-26)28-16-20-35(21-17-28)33(37)31-9-5-7-27-6-3-4-8-30(27)31/h3-13,24,26,28H,14-23H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
48n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against muscarinic acetylcholine receptor M2 stably expressed in CHO-K1 cells using [3H]-QNB as radioligand.


Bioorg Med Chem Lett 12: 1087-91 (2002)


Article DOI: 10.1016/s0960-894x(02)00096-3
BindingDB Entry DOI: 10.7270/Q2MS3S2P
More data for this
Ligand-Target Pair