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Compile Data Set for Download or QSAR

Found 38 hits with Last Name = 'chipkin' and Initial = 're'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
D(1A) dopamine receptor


(RAT)
BDBM82247
PNG
(8-Chloro-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-b...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1 |r|
Show InChI InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1
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0.400n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
In vitro affinity of compound towards dopamine (D1) receptor was determined by measuring their ability to displace [3H]-SCH-23,390 from rat striatal ...


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM82247
PNG
(8-Chloro-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-b...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1 |r|
Show InChI InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1
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0.400n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50004823
PNG
((6aS,13bR)-11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1
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1.90n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017815
PNG
(11-Chloro-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-a...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2C2C1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3
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3.30n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50004823
PNG
((6aS,13bR)-11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1
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3.60n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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3.60n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017818
PNG
(7,11-Dimethyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-be...)
Show SMILES CN1CCc2cc(C)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C20H23NO/c1-13-11-15-9-10-21(2)18-8-7-14-5-3-4-6-16(14)20(18)17(15)12-19(13)22/h3-6,11-12,18,20,22H,7-10H2,1-2H3/t18-,20+/m0/s1
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7.10n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM82247
PNG
(8-Chloro-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-b...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1 |r|
Show InChI InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1
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13.1n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017821
PNG
(12-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2CCN(C)[C@H]3CCc4ccccc4[C@@H]3c2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-19(23-2)18(22)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20+/m0/s1
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24n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017816
PNG
(7-Methyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-benzo[6...)
Show SMILES CN1CCc2cc(O)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H21NO2/c1-20-9-8-13-10-17(21)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-16(19)20/h2-5,10-11,16,19,21-22H,6-9H2,1H3/t16-,19+/m0/s1
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68n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
In vitro affinity of compound towards dopamine (D1) receptor was determined by measuring their ability to displace [3H]-SCH-23,390 from rat striatal ...


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017820
PNG
(7-Methyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-benzo[6...)
Show SMILES CN1CCc2ccc(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H21NO/c1-20-11-10-14-6-8-15(21)12-17(14)19-16-5-3-2-4-13(16)7-9-18(19)20/h2-6,8,12,18-19,21H,7,9-11H2,1H3/t18-,19+/m0/s1
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73n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50004823
PNG
((6aS,13bR)-11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1
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321n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM82247
PNG
(8-Chloro-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-b...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1 |r|
Show InChI InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1
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359n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50010711
PNG
((6aR,13bS )11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19-/m0/s1
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474n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50010711
PNG
((6aR,13bS )11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19-/m0/s1
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513n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50004823
PNG
((6aS,13bR)-11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1
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514n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50010715
PNG
((6aS,13bS)11-Chloro-7-methyl-5,6a,7,8,9,13b-hexahy...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H]2[C@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m1/s1
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531n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM82247
PNG
(8-Chloro-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-b...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1 |r|
Show InChI InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1
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648n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
In vitro affinity of compound towards Dopamine receptor D2 was determined by measuring their ability to displace [3H]-spiperone from rat striatal hom...


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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781n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50010712
PNG
((6aR,13bR)11-Chloro-7-methyl-5,6a,7,8,9,13b-hexahy...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19-/m1/s1
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898n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017818
PNG
(7,11-Dimethyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-be...)
Show SMILES CN1CCc2cc(C)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C20H23NO/c1-13-11-15-9-10-21(2)18-8-7-14-5-3-4-6-16(14)20(18)17(15)12-19(13)22/h3-6,11-12,18,20,22H,7-10H2,1-2H3/t18-,20+/m0/s1
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1.51E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017817
PNG
(12-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2[C@@H]3[C@H](CCc4ccccc34)N(C)CCc2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-18(22)19(23-2)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20+/m0/s1
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1.66E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017819
PNG
(7-Methyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-benzo[6...)
Show SMILES CN1CCc2cc(O)c(O)cc2[C@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H21NO2/c1-20-9-8-13-10-17(21)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-16(19)20/h2-5,10-11,16,19,21-22H,6-9H2,1H3/t16-,19-/m0/s1
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1.73E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
In vitro affinity of compound towards dopamine (D1) receptor was determined by measuring their ability to displace [3H]-SCH-23,390 from rat striatal ...


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017816
PNG
(7-Methyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-benzo[6...)
Show SMILES CN1CCc2cc(O)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H21NO2/c1-20-9-8-13-10-17(21)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-16(19)20/h2-5,10-11,16,19,21-22H,6-9H2,1H3/t16-,19+/m0/s1
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2.41E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
In vitro affinity of compound towards Dopamine receptor D2 was determined by measuring their ability to displace [3H]-spiperone from rat striatal hom...


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017821
PNG
(12-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2CCN(C)[C@H]3CCc4ccccc4[C@@H]3c2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-19(23-2)18(22)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20+/m0/s1
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2.48E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50010715
PNG
((6aS,13bS)11-Chloro-7-methyl-5,6a,7,8,9,13b-hexahy...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H]2[C@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m1/s1
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3.05E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017815
PNG
(11-Chloro-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-a...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2C2C1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3
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4.12E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017823
PNG
(11-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2CCN(C)[C@H]3CCc4ccccc4[C@H]3c2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-19(23-2)18(22)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20-/m0/s1
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4.20E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50004823
PNG
((6aS,13bR)-11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1
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4.27E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by PDSP Ki Database




J Pharmacol Exp Ther 247: 1093-102 (1988)


BindingDB Entry DOI: 10.7270/Q2NK3CHS
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017817
PNG
(12-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2[C@@H]3[C@H](CCc4ccccc34)N(C)CCc2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-18(22)19(23-2)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20+/m0/s1
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6.40E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017820
PNG
(7-Methyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-benzo[6...)
Show SMILES CN1CCc2ccc(O)cc2[C@@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H21NO/c1-20-11-10-14-6-8-15(21)12-17(14)19-16-5-3-2-4-13(16)7-9-18(19)20/h2-6,8,12,18-19,21H,7,9-11H2,1H3/t18-,19+/m0/s1
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7.87E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50010711
PNG
((6aR,13bS )11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19-/m0/s1
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9.07E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50010711
PNG
((6aR,13bS )11-Chloro-7-methyl-5,6a,7,8,9,13b-hexah...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19-/m0/s1
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9.07E+3n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50010712
PNG
((6aR,13bR)11-Chloro-7-methyl-5,6a,7,8,9,13b-hexahy...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@H]1CCc1ccccc21
Show InChI InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19-/m1/s1
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1.63E+4n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50017822
PNG
(12-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2[C@H]3[C@H](CCc4ccccc34)N(C)CCc2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-18(22)19(23-2)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20-/m0/s1
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2.44E+4n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Inhibition of [3H]-SCH-23,390 binding to rat striatal homogenate dopamine receptor D1


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017819
PNG
(7-Methyl-5,6a,7,8,9,13b-hexahydro-6H-7-aza-benzo[6...)
Show SMILES CN1CCc2cc(O)c(O)cc2[C@H]2[C@@H]1CCc1ccccc21
Show InChI InChI=1S/C19H21NO2/c1-20-9-8-13-10-17(21)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-16(19)20/h2-5,10-11,16,19,21-22H,6-9H2,1H3/t16-,19-/m0/s1
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>1.00E+5n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
In vitro affinity of compound towards Dopamine receptor D2 was determined by measuring their ability to displace [3H]-spiperone from rat striatal hom...


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017823
PNG
(11-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2CCN(C)[C@H]3CCc4ccccc4[C@H]3c2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-19(23-2)18(22)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20-/m0/s1
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>1.00E+5n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50017822
PNG
(12-Methoxy-7-methyl-5,6a,7,8,9,13b-hexahydro-6H-7-...)
Show SMILES COc1cc2[C@H]3[C@H](CCc4ccccc34)N(C)CCc2cc1O
Show InChI InChI=1S/C20H23NO2/c1-21-10-9-14-11-18(22)19(23-2)12-16(14)20-15-6-4-3-5-13(15)7-8-17(20)21/h3-6,11-12,17,20,22H,7-10H2,1-2H3/t17-,20-/m0/s1
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>1.00E+5n/an/an/an/an/an/an/an/a



Schering-Plough Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from rat striatal homogenate dopamine receptor D2


J Med Chem 32: 1913-21 (1989)


BindingDB Entry DOI: 10.7270/Q2VQ31P4
More data for this
Ligand-Target Pair