Compile Data Set for Download or QSAR
Found 12044 with Last Name = 'jones' and Initial = 'p'
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50390841(CHEMBL2070787)
Show SMILES CC(=O)N(Cc1cccc(OCCF)c1)c1cnccc1Oc1ccccc1
Show InChI InChI=1S/C22H21FN2O3/c1-17(26)25(16-18-6-5-9-20(14-18)27-13-11-23)21-15-24-12-10-22(21)28-19-7-3-2-4-8-19/h2-10,12,14-15H,11,13,16H2,1H3
Affinity DataKi:  0.0500nMAssay Description:Displacement of [3H]PK11195 from TSPO in Wistar rat heart incubated for 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50390853(CHEMBL2070800)
Show SMILES COc1ccc(OC)c(CN(C(=O)CF)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C23H21F2NO4/c1-28-19-9-11-21(29-2)16(12-19)15-26(23(27)14-24)20-13-17(25)8-10-22(20)30-18-6-4-3-5-7-18/h3-13H,14-15H2,1-2H3
Affinity DataKi:  0.0500nMAssay Description:Displacement of [3H]PK11195 from TSPO in Wistar rat heart incubated for 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491017(CHEMBL2377343)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(ccc1n2CCF)C#N
Show InChI InChI=1S/C23H22FN3OS/c1-3-26(4-2)23(28)22-20-17-13-15(14-25)9-10-18(17)27(12-11-24)21(20)16-7-5-6-8-19(16)29-22/h5-10,13,22H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.190nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50390840(CHEMBL2070786)
Show SMILES COc1ccc(OCCF)cc1CN(C(C)=O)c1cc(F)ccc1Oc1ccccc1
Show InChI InChI=1S/C24H23F2NO4/c1-17(28)27(16-18-14-21(30-13-12-25)9-11-23(18)29-2)22-15-19(26)8-10-24(22)31-20-6-4-3-5-7-20/h3-11,14-15H,12-13,16H2,1-2H3
Affinity DataKi:  0.190nMAssay Description:Displacement of [3H]PK11195 from TSPO in Wistar rat heart incubated for 15 minsMore data for this Ligand-Target Pair
TargetNociceptin receptor(Homo sapiens (Human))
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50311512(2-(3-(1-cyclodecylpiperidin-4-yl)-2-oxo-2,3-dihydr...)
Show SMILES CNC(=O)Cn1c2ccccc2n(C2CCN(CC2)C2CCCCCCCCC2)c1=O
Show InChI InChI=1S/C25H38N4O2/c1-26-24(30)19-28-22-13-9-10-14-23(22)29(25(28)31)21-15-17-27(18-16-21)20-11-7-5-3-2-4-6-8-12-20/h9-10,13-14,20-21H,2-8,11-12,15-19H2,1H3,(H,26,30)
Affinity DataKi:  0.200nMAssay Description:Displacement of [3H]nociceptin from human NOP receptor expressed in CHO cellsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50363527(CHEMBL1945412 | US9481685, [18F]FE-PBR)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3
Affinity DataKi:  0.220nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302760(CHEMBL568818 | N,N-diethyl-4-((1-(2-(furan-3-yl)et...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ccoc2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C28H35N3O3/c1-3-30(4-2)28(33)23-8-10-24(11-9-23)31(26-6-5-7-27(32)20-26)25-13-17-29(18-14-25)16-12-22-15-19-34-21-22/h5-11,15,19-21,25,32H,3-4,12-14,16-18H2,1-2H3
Affinity DataKi:  0.220nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491024(CHEMBL2377352)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(Cl)ccc1n2CCF
Show InChI InChI=1S/C22H22ClFN2OS/c1-3-25(4-2)22(27)21-19-16-13-14(23)9-10-17(16)26(12-11-24)20(19)15-7-5-6-8-18(15)28-21/h5-10,13,21H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.230nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302755(CHEMBL569316 | N,N-diethyl-4-((3-hydroxyphenyl)(1-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ccccn2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C29H36N4O2/c1-3-32(4-2)29(35)23-11-13-25(14-12-23)33(27-9-7-10-28(34)22-27)26-16-20-31(21-17-26)19-15-24-8-5-6-18-30-24/h5-14,18,22,26,34H,3-4,15-17,19-21H2,1-2H3
Affinity DataKi:  0.240nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491021(CHEMBL2377344)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(OC(F)(F)F)ccc1n2CCF
Show InChI InChI=1S/C23H22F4N2O2S/c1-3-28(4-2)22(30)21-19-16-13-14(31-23(25,26)27)9-10-17(16)29(12-11-24)20(19)15-7-5-6-8-18(15)32-21/h5-10,13,21H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.260nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302759(CHEMBL584941 | N,N-diethyl-4-((3-hydroxyphenyl)(1-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ccsc2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C28H35N3O2S/c1-3-30(4-2)28(33)23-8-10-24(11-9-23)31(26-6-5-7-27(32)20-26)25-13-17-29(18-14-25)16-12-22-15-19-34-21-22/h5-11,15,19-21,25,32H,3-4,12-14,16-18H2,1-2H3
Affinity DataKi:  0.270nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50255877(CHEMBL473435 | N-Fluoroacetyl-N-(2,5-dimethoxybenz...)
Show SMILES COc1ccc(OC)c(CN(C(=O)CF)c2ccccc2Oc2ccccc2)c1
Show InChI InChI=1S/C23H22FNO4/c1-27-19-12-13-21(28-2)17(14-19)16-25(23(26)15-24)20-10-6-7-11-22(20)29-18-8-4-3-5-9-18/h3-14H,15-16H2,1-2H3
Affinity DataKi:  0.280nMAssay Description:Displacement of [3H]PK11195 from TSPO in Wistar rat heart incubated for 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM253019(US9481685, 1)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(OC)ccc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-17-14-15(28-3)10-11-18(17)26(13-12-24)21(20)16-8-6-7-9-19(16)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
Affinity DataKi:  0.290nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50490998(CHEMBL2377339)
Show SMILES CCN(CC)C(=O)C1Sc2cc(OC)ccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-16-8-6-7-9-18(16)26(13-12-24)21(20)17-11-10-15(28-3)14-19(17)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
Affinity DataKi:  0.300nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50490999(CHEMBL2377340)
Show SMILES CCN(CC)C(=O)C1Sc2ccc(OC)cc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-16-8-6-7-9-18(16)26(13-12-24)21(20)17-14-15(28-3)10-11-19(17)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
Affinity DataKi:  0.300nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302756(4-((1-(2-(1H-imidazol-2-yl)ethyl)piperidin-4-yl)(3...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ncc[nH]2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C27H35N5O2/c1-3-31(4-2)27(34)21-8-10-22(11-9-21)32(24-6-5-7-25(33)20-24)23-12-17-30(18-13-23)19-14-26-28-15-16-29-26/h5-11,15-16,20,23,33H,3-4,12-14,17-19H2,1-2H3,(H,28,29)
Affinity DataKi:  0.300nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM253021(US9481685, 4)
Show SMILES CCN(CC)C(=O)C1Sc2c(F)cccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H22F2N2OS/c1-3-25(4-2)22(27)21-18-14-8-5-6-11-17(14)26(13-12-23)19(18)15-9-7-10-16(24)20(15)28-21/h5-11,21H,3-4,12-13H2,1-2H3
Affinity DataKi:  0.310nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50390861(CHEMBL2070808)
Show SMILES FCC(=O)N(Cc1cccc2CCOc12)c1ccccc1Oc1ccccc1
Show InChI InChI=1S/C23H20FNO3/c24-15-22(26)25(16-18-8-6-7-17-13-14-27-23(17)18)20-11-4-5-12-21(20)28-19-9-2-1-3-10-19/h1-12H,13-16H2
Affinity DataKi:  0.310nMAssay Description:Displacement of [3H]PK11195 from TSPO in Wistar rat heart incubated for 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM253022(US9481685, 5)
Show SMILES CCN(CC)C(=O)C1Sc2cc(F)ccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H22F2N2OS/c1-3-25(4-2)22(27)21-19-15-7-5-6-8-17(15)26(12-11-23)20(19)16-10-9-14(24)13-18(16)28-21/h5-10,13,21H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.320nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491007(CHEMBL2377334)
Show SMILES CCN(CC)C(=O)C1Sc2cc(O)ccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H23FN2O2S/c1-3-24(4-2)22(27)21-19-15-7-5-6-8-17(15)25(12-11-23)20(19)16-10-9-14(26)13-18(16)28-21/h5-10,13,21,26H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.330nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491013(CHEMBL2377338)
Show SMILES CCN(CC)C(=O)C1Sc2c(OC)cccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-19-15-9-6-7-11-17(15)26(14-13-24)20(19)16-10-8-12-18(28-3)21(16)29-22/h6-12,22H,4-5,13-14H2,1-3H3
Affinity DataKi:  0.330nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491000(CHEMBL2377345)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(C)ccc1n2CCF
Show InChI InChI=1S/C23H25FN2OS/c1-4-25(5-2)23(27)22-20-17-14-15(3)10-11-18(17)26(13-12-24)21(20)16-8-6-7-9-19(16)28-22/h6-11,14,22H,4-5,12-13H2,1-3H3
Affinity DataKi:  0.340nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491004(CHEMBL2377357)
Show SMILES CCN(CC)C(=O)C1Sc2cc(OCCF)ccc2-c2c1c1ccccc1n2C
Show InChI InChI=1S/C23H25FN2O2S/c1-4-26(5-2)23(27)22-20-16-8-6-7-9-18(16)25(3)21(20)17-11-10-15(28-13-12-24)14-19(17)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
Affinity DataKi:  0.350nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491022(CHEMBL2377360)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCCF
Show InChI InChI=1S/C23H25FN2OS/c1-3-25(4-2)23(27)22-20-16-10-5-7-12-18(16)26(15-9-14-24)21(20)17-11-6-8-13-19(17)28-22/h5-8,10-13,22H,3-4,9,14-15H2,1-2H3
Affinity DataKi:  0.360nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM253019(US9481685, 1)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(OC)ccc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-17-14-15(28-3)10-11-18(17)26(13-12-24)21(20)16-8-6-7-9-19(16)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
Affinity DataKi:  0.370nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50363514(CHEMBL1946091)
Show SMILES CCCN(CC)C(=O)C1CCCc2c1c1ccccc1n2CCF
Show InChI InChI=1S/C20H27FN2O/c1-3-13-22(4-2)20(24)16-9-7-11-18-19(16)15-8-5-6-10-17(15)23(18)14-12-21/h5-6,8,10,16H,3-4,7,9,11-14H2,1-2H3
Affinity DataKi:  0.380nMAssay Description:Displacement of [3H]PK11195 from TSPO receptor in Wistar rat heart homogenate after 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50490997(CHEMBL2377337)
Show SMILES CCN(CC)C(=O)C1Sc2ccc(F)cc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H22F2N2OS/c1-3-25(4-2)22(27)21-19-15-7-5-6-8-17(15)26(12-11-23)20(19)16-13-14(24)9-10-18(16)28-21/h5-10,13,21H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.390nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491016(CHEMBL2377332)
Show SMILES CCN(CC)C(=O)C1Sc2cc(NC(C)=O)ccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C24H26FN3O2S/c1-4-27(5-2)24(30)23-21-17-8-6-7-9-19(17)28(13-12-25)22(21)18-11-10-16(26-15(3)29)14-20(18)31-23/h6-11,14,23H,4-5,12-13H2,1-3H3,(H,26,29)
Affinity DataKi:  0.390nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM253024(US9481685, 2)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccc(OC)cc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-16-11-10-15(28-3)14-18(16)26(13-12-24)21(20)17-8-6-7-9-19(17)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
Affinity DataKi:  0.400nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302765(CHEMBL569755 | N,N-diethyl-4-((3-hydroxyphenyl)(1-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ccccc2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C30H37N3O2/c1-3-32(4-2)30(35)25-13-15-26(16-14-25)33(28-11-8-12-29(34)23-28)27-18-21-31(22-19-27)20-17-24-9-6-5-7-10-24/h5-16,23,27,34H,3-4,17-22H2,1-2H3
Affinity DataKi:  0.420nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302758(CHEMBL570000 | N,N-diethyl-4-((1-(2-(furan-2-yl)et...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ccco2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C28H35N3O3/c1-3-30(4-2)28(33)22-10-12-23(13-11-22)31(25-7-5-8-26(32)21-25)24-14-17-29(18-15-24)19-16-27-9-6-20-34-27/h5-13,20-21,24,32H,3-4,14-19H2,1-2H3
Affinity DataKi:  0.420nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50122293(CHEMBL401000 | CHEMBL63064 | N-(2,5-Dimethoxy-benz...)
Show SMILES COc1ccc(OC)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C23H22FNO4/c1-16(26)25(15-17-13-20(27-2)10-12-22(17)28-3)21-14-18(24)9-11-23(21)29-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3
Affinity DataKi:  0.430nMAssay Description:Displacement of [3H]PK11195 from TSPO in Wistar rat heart incubated for 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50390842(CHEMBL2070788)
Show SMILES COc1ccc(OC)c(CN(C(=O)CF)c2ccccc2OC2CCCC2)c1
Show InChI InChI=1S/C22H26FNO4/c1-26-18-11-12-20(27-2)16(13-18)15-24(22(25)14-23)19-9-5-6-10-21(19)28-17-7-3-4-8-17/h5-6,9-13,17H,3-4,7-8,14-15H2,1-2H3
Affinity DataKi:  0.460nMAssay Description:Displacement of [3H]PK11195 from TSPO in Wistar rat heart incubated for 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491006(CHEMBL2377346)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(Br)ccc1n2CCF
Show InChI InChI=1S/C22H22BrFN2OS/c1-3-25(4-2)22(27)21-19-16-13-14(23)9-10-17(16)26(12-11-24)20(19)15-7-5-6-8-18(15)28-21/h5-10,13,21H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.470nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491014(CHEMBL2377347)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(F)ccc1n2CCF
Show InChI InChI=1S/C22H22F2N2OS/c1-3-25(4-2)22(27)21-19-16-13-14(24)9-10-17(16)26(12-11-23)20(19)15-7-5-6-8-18(15)28-21/h5-10,13,21H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.490nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetSomatostatin receptor type 2(Homo sapiens (Human))
Novartis Pharma AG

Curated by ChEMBL
LigandPNGBDBM50192018(CHEMBL3350037)
Show SMILES C[C@@H](O)[C@H](CO)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1
Show InChI InChI=1S/C49H66N10O10S2/c1-28(61)39(25-60)56-48(68)41-27-71-70-26-40(57-43(63)34(51)21-30-13-5-3-6-14-30)47(67)54-37(22-31-15-7-4-8-16-31)45(65)55-38(23-32-24-52-35-18-10-9-17-33(32)35)46(66)53-36(19-11-12-20-50)44(64)59-42(29(2)62)49(69)58-41/h3-10,13-18,24,28-29,34,36-42,52,60-62H,11-12,19-23,25-27,50-51H2,1-2H3,(H,53,66)(H,54,67)(H,55,65)(H,56,68)(H,57,63)(H,58,69)(H,59,64)/t28-,29-,34-,36+,37+,38-,39+,40+,41+,42+/m1/s1
Affinity DataKi:  0.501nMAssay Description:Binding affinity for SSTR2 receptors of rat cortex membranes was determined by using [125I][Tyr3]-octreotide radioligandMore data for this Ligand-Target Pair
TargetNociceptin receptor(Homo sapiens (Human))
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50478160(CHEMBL260767)
Show SMILES CNC(=O)Cn1c2ccccc2n(C2CCN(CC[C@H](Oc3cc(OC)ccc3C)C(C)C)CC2)c1=O
Show InChI InChI=1S/C29H40N4O4/c1-20(2)26(37-27-18-23(36-5)11-10-21(27)3)14-17-31-15-12-22(13-16-31)33-25-9-7-6-8-24(25)32(29(33)35)19-28(34)30-4/h6-11,18,20,22,26H,12-17,19H2,1-5H3,(H,30,34)/t26-/m0/s1
Affinity DataKi:  0.501nMAssay Description:Displacement of [3H]nociceptin from human NOP receptor expressed in CHO cellsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491015(CHEMBL2377359)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCCCF
Show InChI InChI=1S/C24H27FN2OS/c1-3-26(4-2)24(28)23-21-17-11-5-7-13-19(17)27(16-10-9-15-25)22(21)18-12-6-8-14-20(18)29-23/h5-8,11-14,23H,3-4,9-10,15-16H2,1-2H3
Affinity DataKi:  0.520nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM253023(US9481685, 6)
Show SMILES CCOc1ccc2n(CCF)c-3c(C(Sc4ccccc-34)C(=O)N(CC)CC)c2c1
Show InChI InChI=1S/C24H27FN2O2S/c1-4-26(5-2)24(28)23-21-18-15-16(29-6-3)11-12-19(18)27(14-13-25)22(21)17-9-7-8-10-20(17)30-23/h7-12,15,23H,4-6,13-14H2,1-3H3
Affinity DataKi:  0.520nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50491012(CHEMBL2377333)
Show SMILES CCN(CC)C(=O)C1Sc2ccc(O)cc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H23FN2O2S/c1-3-24(4-2)22(27)21-19-15-7-5-6-8-17(15)25(12-11-23)20(19)16-13-14(26)9-10-18(16)28-21/h5-10,13,21,26H,3-4,11-12H2,1-2H3
Affinity DataKi:  0.550nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNociceptin receptor(Homo sapiens (Human))
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50311486(2-[1-(1-Cyclodecyl-piperidin-4-yl)-2,2-dioxo-1,4-d...)
Show SMILES CNC(=O)CN1Cc2ccccc2N(C2CCN(CC2)C2CCCCCCCCC2)S1(=O)=O
Show InChI InChI=1S/C25H40N4O3S/c1-26-25(30)20-28-19-21-11-9-10-14-24(21)29(33(28,31)32)23-15-17-27(18-16-23)22-12-7-5-3-2-4-6-8-13-22/h9-11,14,22-23H,2-8,12-13,15-20H2,1H3,(H,26,30)
Affinity DataKi:  0.600nMAssay Description:Displacement of [3H]nociceptin from human NOP receptor expressed in CHO cellsMore data for this Ligand-Target Pair
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302763(CHEMBL569728 | N,N-diethyl-4-((3-hydroxyphenyl)(1-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2ccc(C)cc2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C31H39N3O2/c1-4-33(5-2)31(36)26-13-15-27(16-14-26)34(29-7-6-8-30(35)23-29)28-18-21-32(22-19-28)20-17-25-11-9-24(3)10-12-25/h6-16,23,28,35H,4-5,17-22H2,1-3H3
Affinity DataKi:  0.640nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302757(CHEMBL568803 | N,N-diethyl-4-((3-hydroxyphenyl)(1-...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2cccs2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C28H35N3O2S/c1-3-30(4-2)28(33)22-10-12-23(13-11-22)31(25-7-5-8-26(32)21-25)24-14-17-29(18-15-24)19-16-27-9-6-20-34-27/h5-13,20-21,24,32H,3-4,14-19H2,1-2H3
Affinity DataKi:  0.650nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50363527(CHEMBL1945412 | US9481685, [18F]FE-PBR)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3
Affinity DataKi:  0.670nMAssay Description:Displacement of [3H]PK11195 from TSPO receptor in Wistar rat heart homogenate after 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50363527(CHEMBL1945412 | US9481685, [18F]FE-PBR)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3
Affinity DataKi:  0.680nMAssay Description:Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenatesMore data for this Ligand-Target Pair
TargetDelta-type opioid receptor(Homo sapiens (Human))
AstraZeneca R & D Montr£al

Curated by ChEMBL
LigandPNGBDBM50302761(CHEMBL569006 | N,N-diethyl-4-((1-(3-fluorophenethy...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(CCc2cccc(F)c2)CC1)c1cccc(O)c1
Show InChI InChI=1S/C30H36FN3O2/c1-3-33(4-2)30(36)24-11-13-26(14-12-24)34(28-9-6-10-29(35)22-28)27-16-19-32(20-17-27)18-15-23-7-5-8-25(31)21-23/h5-14,21-22,27,35H,3-4,15-20H2,1-2H3
Affinity DataKi:  0.700nMAssay Description:Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptorMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50363517(CHEMBL1946094)
Show SMILES CCCCCCN(CCCCCC)C(=O)C1CCCc2c1c1ccccc1n2CCF
Show InChI InChI=1S/C27H41FN2O/c1-3-5-7-11-19-29(20-12-8-6-4-2)27(31)23-15-13-17-25-26(23)22-14-9-10-16-24(22)30(25)21-18-28/h9-10,14,16,23H,3-8,11-13,15,17-21H2,1-2H3
Affinity DataKi:  0.700nMAssay Description:Displacement of [3H]PK11195 from TSPO receptor in Wistar rat heart homogenate after 15 minsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50363516(CHEMBL1946093)
Show SMILES CCCN(CCC)C(=O)C1CCCc2c1c1ccccc1n2CCF
Show InChI InChI=1S/C21H29FN2O/c1-3-13-23(14-4-2)21(25)17-9-7-11-19-20(17)16-8-5-6-10-18(16)24(19)15-12-22/h5-6,8,10,17H,3-4,7,9,11-15H2,1-2H3
Affinity DataKi:  0.700nMAssay Description:Displacement of [3H]PK11195 from TSPO receptor in Wistar rat heart homogenate after 15 minsMore data for this Ligand-Target Pair
TargetNociceptin receptor(Homo sapiens (Human))
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50311475(2-(3-(1-((1s,4s)-4-isopropylcyclohexyl)piperidin-4...)
Show SMILES CNC(=O)Cn1c2ccccc2n(C2CCN(CC2)[C@@H]2CC[C@@H](CC2)C(C)C)c1=O
Show InChI InChI=1S/C24H36N4O2/c1-17(2)18-8-10-19(11-9-18)26-14-12-20(13-15-26)28-22-7-5-4-6-21(22)27(24(28)30)16-23(29)25-3/h4-7,17-20H,8-16H2,1-3H3,(H,25,29)/t18-,19+
Affinity DataKi:  0.700nMAssay Description:Displacement of [3H]nociceptin from human NOP receptor expressed in CHO cellsMore data for this Ligand-Target Pair
TargetTranslocator protein(Rattus norvegicus (rat))
GE Healthcare

Curated by ChEMBL
LigandPNGBDBM50363519(CHEMBL1946096)
Show SMILES CCN(Cc1ccccc1)C(=O)C1CCCc2c1c1ccccc1n2CCF
Show InChI InChI=1S/C24H27FN2O/c1-2-26(17-18-9-4-3-5-10-18)24(28)20-12-8-14-22-23(20)19-11-6-7-13-21(19)27(22)16-15-25/h3-7,9-11,13,20H,2,8,12,14-17H2,1H3
Affinity DataKi:  0.730nMAssay Description:Displacement of [3H]PK11195 from TSPO receptor in Wistar rat heart homogenate after 15 minsMore data for this Ligand-Target Pair
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