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39 similar compounds to monomer 50034043

Compile data set for download or QSAR
Wt: 396.4
BDBM50034032
Wt: 412.4
BDBM50034033
Wt: 422.5
BDBM50034034
Wt: 424.4
BDBM50034035
Wt: 424.5
BDBM50034037
Wt: 426.4
BDBM50034039
Wt: 427.4
BDBM50034040
Wt: 440.5
BDBM50034041
Wt: 480.4
BDBM50034042
Wt: 456.9
BDBM50034044
Wt: 442.9
BDBM50034045
Wt: 354.4
BDBM50034046
Wt: 369.4
BDBM50034047
Wt: 439.5
BDBM50034049
Wt: 440.5
BDBM50034050
Displayed 1 to 15 (of 39 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50034032,50034033,50034034,50034035,50034037,50034039,50034040,50034041,50034042,50034044,50034045,50034046,50034047,50034049,50034050   
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
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034032
PNG
(1-(4-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperi...)
Show SMILES CC(=O)c1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)cc1
Show InChI InChI=1S/C23H25FN2O3/c1-16(27)17-3-6-20(7-4-17)28-14-2-11-26-12-9-18(10-13-26)23-21-8-5-19(24)15-22(21)29-25-23/h3-8,15,18H,2,9-14H2,1H3
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n/an/a 16n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034033
PNG
(3-{1-[3-(4-Ethyl-2-methoxy-phenoxy)-propyl]-piperi...)
Show SMILES CCc1ccc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)c(OC)c1
Show InChI InChI=1S/C24H29FN2O3/c1-3-17-5-8-21(23(15-17)28-2)29-14-4-11-27-12-9-18(10-13-27)24-20-7-6-19(25)16-22(20)30-26-24/h5-8,15-16,18H,3-4,9-14H2,1-2H3
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n/an/a 213n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034034
PNG
(1-{4-[4-(4-Benzo[d]isoxazol-3-yl-piperidin-1-yl)-b...)
Show SMILES COc1cc(ccc1OCCCCN1CCC(CC1)c1noc2ccccc12)C(C)=O
Show InChI InChI=1S/C25H30N2O4/c1-18(28)20-9-10-23(24(17-20)29-2)30-16-6-5-13-27-14-11-19(12-15-27)25-21-7-3-4-8-22(21)31-26-25/h3-4,7-10,17,19H,5-6,11-16H2,1-2H3
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n/an/a 66n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034037
PNG
(6-Fluoro-3-{1-[3-(4-isopropenyl-2-methoxy-phenoxy)...)
Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=C
Show InChI InChI=1S/C25H29FN2O3/c1-17(2)19-5-8-22(24(15-19)29-3)30-14-4-11-28-12-9-18(10-13-28)25-21-7-6-20(26)16-23(21)31-27-25/h5-8,15-16,18H,1,4,9-14H2,2-3H3
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n/an/a 221n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034039
PNG
(1-(4-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperi...)
Show SMILES COc1cc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1C(C)=O
Show InChI InChI=1S/C24H27FN2O4/c1-16(28)20-7-5-19(15-22(20)29-2)30-13-3-10-27-11-8-17(9-12-27)24-21-6-4-18(25)14-23(21)31-26-24/h4-7,14-15,17H,3,8-13H2,1-2H3
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n/an/a 237n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034040
PNG
(4-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(N)=O
Show InChI InChI=1S/C23H26FN3O4/c1-29-21-13-16(23(25)28)3-6-19(21)30-12-2-9-27-10-7-15(8-11-27)22-18-5-4-17(24)14-20(18)31-26-22/h3-6,13-15H,2,7-12H2,1H3,(H2,25,28)
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n/an/a 59n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034042
PNG
(2,2,2-Trifluoro-1-(4-{3-[4-(6-fluoro-benzo[d]isoxa...)
Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(=O)C(F)(F)F
Show InChI InChI=1S/C24H24F4N2O4/c1-32-21-13-16(23(31)24(26,27)28)3-6-19(21)33-12-2-9-30-10-7-15(8-11-30)22-18-5-4-17(25)14-20(18)34-29-22/h3-6,13-15H,2,7-12H2,1H3
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n/an/a 169n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034045
PNG
(1-(4-{3-[4-(6-Chloro-benzo[d]isoxazol-3-yl)-piperi...)
Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(Cl)ccc12)C(C)=O
Show InChI InChI=1S/C24H27ClN2O4/c1-16(28)18-4-7-21(23(14-18)29-2)30-13-3-10-27-11-8-17(9-12-27)24-20-6-5-19(25)15-22(20)31-26-24/h4-7,14-15,17H,3,8-13H2,1-2H3
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n/an/a 111n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034047
PNG
(2-{3-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Show SMILES Nc1ccccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C21H24FN3O2/c22-16-6-7-17-20(14-16)27-24-21(17)15-8-11-25(12-9-15)10-3-13-26-19-5-2-1-4-18(19)23/h1-2,4-7,14-15H,3,8-13,23H2
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n/an/a 40n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034044
PNG
(1-(4-{4-[4-(6-Chloro-benzo[d]isoxazol-3-yl)-piperi...)
Show SMILES COc1cc(ccc1OCCCCN1CCC(CC1)c1noc2cc(Cl)ccc12)C(C)=O
Show InChI InChI=1S/C25H29ClN2O4/c1-17(29)19-5-8-22(24(15-19)30-2)31-14-4-3-11-28-12-9-18(10-13-28)25-21-7-6-20(26)16-23(21)32-27-25/h5-8,15-16,18H,3-4,9-14H2,1-2H3
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n/an/a 110n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034041
PNG
(1-(4-{4-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperi...)
Show SMILES COc1cc(ccc1OCCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O
Show InChI InChI=1S/C25H29FN2O4/c1-17(29)19-5-8-22(24(15-19)30-2)31-14-4-3-11-28-12-9-18(10-13-28)25-21-7-6-20(26)16-23(21)32-27-25/h5-8,15-16,18H,3-4,9-14H2,1-2H3
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n/an/a 23n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034049
PNG
(1-(3-Dimethylamino-4-{3-[4-(6-fluoro-benzo[d]isoxa...)
Show SMILES CN(C)c1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O
Show InChI InChI=1S/C25H30FN3O3/c1-17(30)19-5-8-23(22(15-19)28(2)3)31-14-4-11-29-12-9-18(10-13-29)25-21-7-6-20(26)16-24(21)32-27-25/h5-8,15-16,18H,4,9-14H2,1-3H3
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n/an/a 116n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034050
PNG
(CHEMBL275016 | [1-(4-{3-[4-(6-Fluoro-benzo[d]isoxa...)
Show SMILES COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)N=N
Show InChI InChI=1S/C24H29FN4O3/c1-16(27-26)18-4-7-21(23(14-18)30-2)31-13-3-10-29-11-8-17(9-12-29)24-20-6-5-19(25)15-22(20)32-28-24/h4-7,14-17,26H,3,8-13H2,1-2H3
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n/an/a 107n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034046
PNG
(6-Fluoro-3-[1-(3-phenoxy-propyl)-piperidin-4-yl]-b...)
Show SMILES Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccccc2)CC1
Show InChI InChI=1S/C21H23FN2O2/c22-17-7-8-19-20(15-17)26-23-21(19)16-9-12-24(13-10-16)11-4-14-25-18-5-2-1-3-6-18/h1-3,5-8,15-16H,4,9-14H2
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n/an/a 364n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50034035
PNG
(1-(2-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperi...)
Show SMILES CC(=O)c1ccc2OC(CCN3CCC(CC3)c3noc4cc(F)ccc34)COc2c1
Show InChI InChI=1S/C24H25FN2O4/c1-15(28)17-2-5-21-23(12-17)29-14-19(30-21)8-11-27-9-6-16(7-10-27)24-20-4-3-18(25)13-22(20)31-26-24/h2-5,12-13,16,19H,6-11,14H2,1H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Affinity for dopamine receptor D2 binding sites by its ability to displace [3H]spiperone from rat striatum.


J Med Chem 38: 1119-31 (1995)


Article DOI: 10.1021/jm00007a009
BindingDB Entry DOI: 10.7270/Q2S75H08
More data for this
Ligand-Target Pair