BindingDB logo
myBDB logout

9 similar compounds to monomer 50082792

Compile data set for download or QSAR
Wt: 562.6
BDBM50082786
Wt: 593.6
BDBM50082787
Wt: 583.0
BDBM50082791
Wt: 579.6
BDBM50082793
Wt: 562.6
BDBM50082795
Wt: 583.0
BDBM50082796
Wt: 566.6
BDBM50082799
Wt: 607.6
BDBM50082801
Wt: 574.5
BDBM50085000

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 33 hits for monomerid = 50082786,50082787,50082791,50082793,50082795,50082796,50082799,50082801,50085000   
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
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082801
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES CCOC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H37N5O8/c1-4-44-27(37)25-21(2)33-30(40)35(26(25)22-11-13-24(14-12-22)36(41)42)29(39)32-17-8-18-34-19-15-31(16-20-34,28(38)43-3)23-9-6-5-7-10-23/h5-7,9-14,26H,4,8,15-20H2,1-3H3,(H,32,39)(H,33,40)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.300n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50085000
PNG
(1-{3-[(4-Benzo[1,2,5]oxadiazol-5-yl-2,5-dioxo-1,2,...)
Show SMILES COC(=O)C1(CCN(CCCNC(=O)N2C(C3=C(COC3=O)NC2=O)c2ccc3nonc3c2)CC1)c1ccccc1
Show InChI InChI=1S/C29H30N6O7/c1-40-26(37)29(19-6-3-2-4-7-19)10-14-34(15-11-29)13-5-12-30-27(38)35-24(18-8-9-20-21(16-18)33-42-32-20)23-22(31-28(35)39)17-41-25(23)36/h2-4,6-9,16,24H,5,10-15,17H2,1H3,(H,30,38)(H,31,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.900n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]- prazosin from human recombinant Alpha-1A adrenergic receptor


Bioorg Med Chem Lett 10: 175-8 (2000)


Article DOI: 10.1016/s0960-894x(99)00653-8
BindingDB Entry DOI: 10.7270/Q2N29W5M
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082796
PNG
(4-(3-Chloro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1cccc(Cl)c1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35ClN4O6/c1-20-24(26(36)40-2)25(21-9-7-12-23(31)19-21)35(29(39)33-20)28(38)32-15-8-16-34-17-13-30(14-18-34,27(37)41-3)22-10-5-4-6-11-22/h4-7,9-12,19,25H,8,13-18H2,1-3H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.10n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082799
PNG
(4-(4-Fluoro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35FN4O6/c1-20-24(26(36)40-2)25(21-10-12-23(31)13-11-21)35(29(39)33-20)28(38)32-16-7-17-34-18-14-30(15-19-34,27(37)41-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.20n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082786
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1cccc(C)c1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H38N4O6/c1-21-10-8-11-23(20-21)26-25(27(36)40-3)22(2)33-30(39)35(26)29(38)32-16-9-17-34-18-14-31(15-19-34,28(37)41-4)24-12-6-5-7-13-24/h5-8,10-13,20,26H,9,14-19H2,1-4H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.80n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082791
PNG
(4-(4-Chloro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(Cl)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35ClN4O6/c1-20-24(26(36)40-2)25(21-10-12-23(31)13-11-21)35(29(39)33-20)28(38)32-16-7-17-34-18-14-30(15-19-34,27(37)41-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.5n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082795
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(C)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H38N4O6/c1-21-11-13-23(14-12-21)26-25(27(36)40-3)22(2)33-30(39)35(26)29(38)32-17-8-18-34-19-15-31(16-20-34,28(37)41-4)24-9-6-5-7-10-24/h5-7,9-14,26H,8,15-20H2,1-4H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
8n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50082793
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1(CCN(CCCNC(=O)N2C(C(C(O)=O)=C(C)NC2=O)c2ccc(cc2)[N+]([O-])=O)CC1)c1ccccc1
Show InChI InChI=1S/C29H33N5O8/c1-19-23(25(35)36)24(20-9-11-22(12-10-20)34(40)41)33(28(39)31-19)27(38)30-15-6-16-32-17-13-29(14-18-32,26(37)42-2)21-7-4-3-5-8-21/h3-5,7-12,24H,6,13-18H2,1-2H3,(H,30,38)(H,31,39)(H,35,36)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
10n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1A adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082801
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES CCOC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H37N5O8/c1-4-44-27(37)25-21(2)33-30(40)35(26(25)22-11-13-24(14-12-22)36(41)42)29(39)32-17-8-18-34-19-15-31(16-20-34,28(38)43-3)23-9-6-5-7-10-23/h5-7,9-14,26H,4,8,15-20H2,1-3H3,(H,32,39)(H,33,40)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
15n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
19n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
28n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082791
PNG
(4-(4-Chloro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(Cl)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35ClN4O6/c1-20-24(26(36)40-2)25(21-10-12-23(31)13-11-21)35(29(39)33-20)28(38)32-16-7-17-34-18-14-30(15-19-34,27(37)41-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,32,38)(H,33,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082796
PNG
(4-(3-Chloro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1cccc(Cl)c1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35ClN4O6/c1-20-24(26(36)40-2)25(21-9-7-12-23(31)19-21)35(29(39)33-20)28(38)32-15-8-16-34-17-13-30(14-18-34,27(37)41-3)22-10-5-4-6-11-22/h4-7,9-12,19,25H,8,13-18H2,1-3H3,(H,32,38)(H,33,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
50n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082795
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(C)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H38N4O6/c1-21-11-13-23(14-12-21)26-25(27(36)40-3)22(2)33-30(39)35(26)29(38)32-17-8-18-34-19-15-31(16-20-34,28(37)41-4)24-9-6-5-7-10-24/h5-7,9-14,26H,8,15-20H2,1-4H3,(H,32,38)(H,33,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
77n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082799
PNG
(4-(4-Fluoro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35FN4O6/c1-20-24(26(36)40-2)25(21-10-12-23(31)13-11-21)35(29(39)33-20)28(38)32-16-7-17-34-18-14-30(15-19-34,27(37)41-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,32,38)(H,33,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
78n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
80n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
81n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082801
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES CCOC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H37N5O8/c1-4-44-27(37)25-21(2)33-30(40)35(26(25)22-11-13-24(14-12-22)36(41)42)29(39)32-17-8-18-34-19-15-31(16-20-34,28(38)43-3)23-9-6-5-7-10-23/h5-7,9-14,26H,4,8,15-20H2,1-3H3,(H,32,39)(H,33,40)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
91n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
100n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082786
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1cccc(C)c1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H38N4O6/c1-21-10-8-11-23(20-21)26-25(27(36)40-3)22(2)33-30(39)35(26)29(38)32-16-9-17-34-18-14-31(15-19-34,28(37)41-4)24-12-6-5-7-13-24/h5-8,10-13,20,26H,9,14-19H2,1-4H3,(H,32,38)(H,33,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
110n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082791
PNG
(4-(4-Chloro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(Cl)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35ClN4O6/c1-20-24(26(36)40-2)25(21-10-12-23(31)13-11-21)35(29(39)33-20)28(38)32-16-7-17-34-18-14-30(15-19-34,27(37)41-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
170n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082799
PNG
(4-(4-Fluoro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35FN4O6/c1-20-24(26(36)40-2)25(21-10-12-23(31)13-11-21)35(29(39)33-20)28(38)32-16-7-17-34-18-14-30(15-19-34,27(37)41-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
180n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082787
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)[N+]([O-])=O)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
180n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082796
PNG
(4-(3-Chloro-phenyl)-3-[3-(4-methoxycarbonyl-4-phen...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1cccc(Cl)c1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C30H35ClN4O6/c1-20-24(26(36)40-2)25(21-9-7-12-23(31)19-21)35(29(39)33-20)28(38)32-15-8-16-34-17-13-30(14-18-34,27(37)41-3)22-10-5-4-6-11-22/h4-7,9-12,19,25H,8,13-18H2,1-3H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
180n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082795
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(C)cc1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H38N4O6/c1-21-11-13-23(14-12-21)26-25(27(36)40-3)22(2)33-30(39)35(26)29(38)32-17-8-18-34-19-15-31(16-20-34,28(37)41-4)24-9-6-5-7-10-24/h5-7,9-14,26H,8,15-20H2,1-4H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
220n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50085000
PNG
(1-{3-[(4-Benzo[1,2,5]oxadiazol-5-yl-2,5-dioxo-1,2,...)
Show SMILES COC(=O)C1(CCN(CCCNC(=O)N2C(C3=C(COC3=O)NC2=O)c2ccc3nonc3c2)CC1)c1ccccc1
Show InChI InChI=1S/C29H30N6O7/c1-40-26(37)29(19-6-3-2-4-7-19)10-14-34(15-11-29)13-5-12-30-27(38)35-24(18-8-9-20-21(16-18)33-42-32-20)23-22(31-28(35)39)17-41-25(23)36/h2-4,6-9,16,24H,5,10-15,17H2,1H3,(H,30,38)(H,31,39)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
300n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]- prazosin from human recombinant Alpha-1B adrenergic receptor


Bioorg Med Chem Lett 10: 175-8 (2000)


Article DOI: 10.1016/s0960-894x(99)00653-8
BindingDB Entry DOI: 10.7270/Q2N29W5M
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082786
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1cccc(C)c1)C(=O)NCCCN1CCC(CC1)(C(=O)OC)c1ccccc1
Show InChI InChI=1S/C31H38N4O6/c1-21-10-8-11-23(20-21)26-25(27(36)40-3)22(2)33-30(39)35(26)29(38)32-16-9-17-34-18-14-31(15-19-34,28(37)41-4)24-12-6-5-7-13-24/h5-8,10-13,20,26H,9,14-19H2,1-4H3,(H,32,38)(H,33,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
320n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50085000
PNG
(1-{3-[(4-Benzo[1,2,5]oxadiazol-5-yl-2,5-dioxo-1,2,...)
Show SMILES COC(=O)C1(CCN(CCCNC(=O)N2C(C3=C(COC3=O)NC2=O)c2ccc3nonc3c2)CC1)c1ccccc1
Show InChI InChI=1S/C29H30N6O7/c1-40-26(37)29(19-6-3-2-4-7-19)10-14-34(15-11-29)13-5-12-30-27(38)35-24(18-8-9-20-21(16-18)33-42-32-20)23-22(31-28(35)39)17-41-25(23)36/h2-4,6-9,16,24H,5,10-15,17H2,1H3,(H,30,38)(H,31,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
340n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]- prazosin from human recombinant Alpha-1D adrenergic receptor


Bioorg Med Chem Lett 10: 175-8 (2000)


Article DOI: 10.1016/s0960-894x(99)00653-8
BindingDB Entry DOI: 10.7270/Q2N29W5M
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50082793
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1(CCN(CCCNC(=O)N2C(C(C(O)=O)=C(C)NC2=O)c2ccc(cc2)[N+]([O-])=O)CC1)c1ccccc1
Show InChI InChI=1S/C29H33N5O8/c1-19-23(25(35)36)24(20-9-11-22(12-10-20)34(40)41)33(28(39)31-19)27(38)30-15-6-16-32-17-13-29(14-18-32,26(37)42-2)21-7-4-3-5-8-21/h3-5,7-12,24H,6,13-18H2,1-2H3,(H,30,38)(H,31,39)(H,35,36)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.60E+3n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50082793
PNG
(3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-p...)
Show SMILES COC(=O)C1(CCN(CCCNC(=O)N2C(C(C(O)=O)=C(C)NC2=O)c2ccc(cc2)[N+]([O-])=O)CC1)c1ccccc1
Show InChI InChI=1S/C29H33N5O8/c1-19-23(25(35)36)24(20-9-11-22(12-10-20)34(40)41)33(28(39)31-19)27(38)30-15-6-16-32-17-13-29(14-18-32,26(37)42-2)21-7-4-3-5-8-21/h3-5,7-12,24H,6,13-18H2,1-2H3,(H,30,38)(H,31,39)(H,35,36)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.60E+3n/an/an/an/an/an/an/an/a



Synaptic Pharmaceutical Corporation

Curated by ChEMBL


Assay Description
In vitro binding affinity against Alpha-1D adrenergic receptor of human liver microsomes.


J Med Chem 42: 4764-77 (1999)


Article DOI: 10.1021/jm990200p
BindingDB Entry DOI: 10.7270/Q2W959W2
More data for this
Ligand-Target Pair