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6 similar compounds to monomer 50000383

Compile data set for download or QSAR
Wt: 382.4
BDBM50000341
Wt: 435.5
BDBM50000351
Wt: 378.5
BDBM50000353
Wt: 380.5
BDBM50000365
Wt: 448.5
BDBM50000379
Wt: 420.4
BDBM50000389

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50000341,50000351,50000353,50000365,50000379,50000389   
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
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000341
PNG
(1-(2-Dimethylamino-ethyl)-6-methoxy-4-(4-methoxy-p...)
Show SMILES COc1ccc(cc1)[C@@H]1Cc2c(OC)cccc2N(CCN(C)C)C(=O)[C@@H]1C
Show InChI InChI=1S/C23H30N2O3/c1-16-19(17-9-11-18(27-4)12-10-17)15-20-21(7-6-8-22(20)28-5)25(23(16)26)14-13-24(2)3/h6-12,16,19H,13-15H2,1-5H3/t16-,19-/m1/s1
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Article
PubMed
n/an/an/a 400n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000351
PNG
(CHEMBL352750 | {2-[4-(4-Methoxy-phenyl)-3-methyl-2...)
Show SMILES COc1ccc(cc1)[C@@H]1Cc2c(cccc2C(F)(F)F)N(CC[N+](C)(C)C)C(=O)[C@@H]1C
Show InChI InChI=1S/C24H30F3N2O2/c1-16-19(17-9-11-18(31-5)12-10-17)15-20-21(24(25,26)27)7-6-8-22(20)28(23(16)30)13-14-29(2,3)4/h6-12,16,19H,13-15H2,1-5H3/q+1/t16-,19-/m1/s1
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Article
PubMed
n/an/an/a 840n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000389
PNG
(1-(2-Dimethylamino-ethyl)-4-(4-methoxy-phenyl)-3-m...)
Show SMILES COc1ccc(cc1)[C@@H]1Cc2c(cccc2C(F)(F)F)N(CCN(C)C)C(=O)[C@@H]1C
Show InChI InChI=1S/C23H27F3N2O2/c1-15-18(16-8-10-17(30-4)11-9-16)14-19-20(23(24,25)26)6-5-7-21(19)28(22(15)29)13-12-27(2)3/h5-11,15,18H,12-14H2,1-4H3/t15-,18-/m1/s1
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Article
PubMed
n/an/an/a 75n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000379
PNG
(1-[2-(Isopropyl-methyl-amino)-ethyl]-4-(4-methoxy-...)
Show SMILES COc1ccc(cc1)[C@@H]1Cc2c(cccc2C(F)(F)F)N(CCN(C)C(C)C)C(=O)[C@@H]1C
Show InChI InChI=1S/C25H31F3N2O2/c1-16(2)29(4)13-14-30-23-8-6-7-22(25(26,27)28)21(23)15-20(17(3)24(30)31)18-9-11-19(32-5)12-10-18/h6-12,16-17,20H,13-15H2,1-5H3/t17-,20-/m1/s1
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PubMed
n/an/an/a 130n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000353
PNG
(3-Allyl-1-(2-dimethylamino-ethyl)-4-(4-methoxy-phe...)
Show SMILES COc1ccc(cc1)[C@@H]1Cc2ccccc2N(CCN(C)C)C(=O)[C@@H]1CC=C
Show InChI InChI=1S/C24H30N2O2/c1-5-8-21-22(18-11-13-20(28-4)14-12-18)17-19-9-6-7-10-23(19)26(24(21)27)16-15-25(2)3/h5-7,9-14,21-22H,1,8,15-17H2,2-4H3/t21-,22+/m1/s1
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Article
PubMed
n/an/an/a 52n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000365
PNG
(1-(2-Dimethylamino-ethyl)-4-(4-methoxy-phenyl)-3-p...)
Show SMILES CCC[C@@H]1[C@@H](Cc2ccccc2N(CCN(C)C)C1=O)c1ccc(OC)cc1
Show InChI InChI=1S/C24H32N2O2/c1-5-8-21-22(18-11-13-20(28-4)14-12-18)17-19-9-6-7-10-23(19)26(24(21)27)16-15-25(2)3/h6-7,9-14,21-22H,5,8,15-17H2,1-4H3/t21-,22+/m1/s1
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Article
PubMed
n/an/an/a 250n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair