Found 13 hits Enz. Inhib. hit(s) with all data for entry = 4795 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Beta-arrestin-1
(RABBIT) | BDBM50018550
(1'-Benzyl-3-phenyl-[3,4']bipiperidinyl-2,6-dione |...)Show SMILES O=C1CC[C@](C2CCN(Cc3ccccc3)CC2)(C(=O)N1)c1ccccc1 Show InChI InChI=1S/C23H26N2O2/c26-21-11-14-23(22(27)24-21,19-9-5-2-6-10-19)20-12-15-25(16-13-20)17-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,24,26,27)/t23-/m0/s1 | PDB
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| 0.120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM86231
(ATR | ATROPINE | Atropine,(-) | CAS_51-55-8 | CHEM...)Show SMILES CN1C2CCC1CC(C2)OC(=O)C(CO)c1ccccc1 |THB:9:7:1:3.4| Show InChI InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3 | PDB
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| 0.180 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM50018550
(1'-Benzyl-3-phenyl-[3,4']bipiperidinyl-2,6-dione |...)Show SMILES O=C1CC[C@](C2CCN(Cc3ccccc3)CC2)(C(=O)N1)c1ccccc1 Show InChI InChI=1S/C23H26N2O2/c26-21-11-14-23(22(27)24-21,19-9-5-2-6-10-19)20-12-15-25(16-13-20)17-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,24,26,27)/t23-/m0/s1 | PDB
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| 3.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM39341
(11-[(4-methylpiperazin-1-yl)acetyl]-5,11-dihydro-6...)Show InChI InChI=1S/C19H21N5O2/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24/h2-8H,9-13H2,1H3,(H,21,26) | PDB
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| 5.31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM86231
(ATR | ATROPINE | Atropine,(-) | CAS_51-55-8 | CHEM...)Show SMILES CN1C2CCC1CC(C2)OC(=O)C(CO)c1ccccc1 |THB:9:7:1:3.4| Show InChI InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3 | PDB
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| 6.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM50004665
((oxotremorine)1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyr...)Show InChI InChI=1S/C12H18N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h1-2,5-11H2 | PDB
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| 214 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM39341
(11-[(4-methylpiperazin-1-yl)acetyl]-5,11-dihydro-6...)Show InChI InChI=1S/C19H21N5O2/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24/h2-8H,9-13H2,1H3,(H,21,26) | PDB
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| 442 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM50018550
(1'-Benzyl-3-phenyl-[3,4']bipiperidinyl-2,6-dione |...)Show SMILES O=C1CC[C@](C2CCN(Cc3ccccc3)CC2)(C(=O)N1)c1ccccc1 Show InChI InChI=1S/C23H26N2O2/c26-21-11-14-23(22(27)24-21,19-9-5-2-6-10-19)20-12-15-25(16-13-20)17-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,24,26,27)/t23-/m0/s1 | PDB
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| 571 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM50004665
((oxotremorine)1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyr...)Show InChI InChI=1S/C12H18N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h1-2,5-11H2 | PDB
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| 1.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM50004656
((2-Carbamoyloxy-ethyl)-trimethyl-ammonium | (2-Car...)Show InChI InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1 | PDB
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| 1.66E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM10759
(2-acetoxyethyl(trimethyl)ammonium;bromide | 2-acet...)Show InChI InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1 | PDB
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| 3.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM50018550
(1'-Benzyl-3-phenyl-[3,4']bipiperidinyl-2,6-dione |...)Show SMILES O=C1CC[C@](C2CCN(Cc3ccccc3)CC2)(C(=O)N1)c1ccccc1 Show InChI InChI=1S/C23H26N2O2/c26-21-11-14-23(22(27)24-21,19-9-5-2-6-10-19)20-12-15-25(16-13-20)17-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,24,26,27)/t23-/m0/s1 | PDB
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| 7.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
Beta-arrestin-1
(RABBIT) | BDBM50004656
((2-Carbamoyloxy-ethyl)-trimethyl-ammonium | (2-Car...)Show InChI InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1 | PDB
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| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 240: 51-8 (1987)
BindingDB Entry DOI: 10.7270/Q2XW4H9Q |
More data for this
Ligand-Target Pair | |
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