Found 628 hits with Last Name = 'kolczewski' and Initial = 's' 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 |
|---|
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474329
(CHEMBL315551)Show SMILES [H][C@]12CN(C)C[C@@]1([H])C1(CCN(CC1)C1CCCCCCCCC1)N(C2)c1ccccc1 Show InChI InChI=1S/C27H43N3/c1-28-20-23-21-30(25-14-10-7-11-15-25)27(26(23)22-28)16-18-29(19-17-27)24-12-8-5-3-2-4-6-9-13-24/h7,10-11,14-15,23-24,26H,2-6,8-9,12-13,16-22H2,1H3/t23-,26-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| 0.447 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474331
(CHEMBL316086)Show SMILES [H][C@]12CN(C)C[C@@]1([H])C1(CCN(CC1)[C@H]1CC[C@]3([H])CCCC[C@]3([H])C1)N(C2)c1ccccc1 Show InChI InChI=1S/C27H41N3/c1-28-18-23-19-30(24-9-3-2-4-10-24)27(26(23)20-28)13-15-29(16-14-27)25-12-11-21-7-5-6-8-22(21)17-25/h2-4,9-10,21-23,25-26H,5-8,11-20H2,1H3/t21-,22+,23+,25-,26+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 0.525 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474328
(CHEMBL330291)Show SMILES [H][C@]12CN(C)C[C@@]1([H])C1(CCN(CC1)C1CCCCCCCC1)N(C2)c1ccccc1 Show InChI InChI=1S/C26H41N3/c1-27-19-22-20-29(24-13-9-6-10-14-24)26(25(22)21-27)15-17-28(18-16-26)23-11-7-4-2-3-5-8-12-23/h6,9-10,13-14,22-23,25H,2-5,7-8,11-12,15-21H2,1H3/t22-,25-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 0.646 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474330
(CHEMBL2112342)Show SMILES [H][C@]12CN(CCCC)C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1 |wU:17.18,20.25,1.0,9.10,(8.36,-6.3,;7.25,-5.22,;8.5,-4.32,;8.04,-2.86,;8.95,-1.61,;10.48,-1.78,;11.39,-.54,;12.91,-.71,;6.5,-2.85,;6.01,-4.32,;4.98,-3.18,;4.76,-5.22,;4.13,-6.62,;2.61,-6.79,;1.7,-5.54,;2.33,-4.13,;3.85,-3.97,;.17,-5.71,;-.74,-4.46,;-2.27,-4.62,;-2.9,-6.02,;-2,-7.27,;-.46,-7.11,;-4.44,-6.18,;-5.07,-7.58,;-5.33,-4.92,;5.25,-6.69,;6.79,-6.69,;4.4,-7.97,;2.86,-7.88,;2.01,-9.16,;2.7,-10.55,;4.24,-10.64,;5.09,-9.35,)| Show InChI InChI=1S/C29H47N3/c1-4-5-17-30-20-25-21-32(27-9-7-6-8-10-27)29(28(25)22-30)15-18-31(19-16-29)26-13-11-24(12-14-26)23(2)3/h6-10,23-26,28H,4-5,11-22H2,1-3H3/t24-,25-,26+,28-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 0.661 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474321
(CHEMBL2112348)Show SMILES [H][C@]12CN(CCO)C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1 |wU:16.17,19.24,8.9,1.0,(13.25,-6.15,;12.15,-5.08,;13.39,-4.17,;12.92,-2.72,;13.84,-1.47,;15.36,-1.64,;16.27,-.4,;11.39,-2.71,;10.9,-4.17,;9.87,-3.03,;9.66,-5.08,;9.04,-6.48,;7.5,-6.64,;6.59,-5.4,;7.22,-3.99,;8.76,-3.82,;5.07,-5.56,;4.16,-4.31,;2.64,-4.47,;2.01,-5.87,;2.92,-7.13,;4.43,-6.96,;.47,-6.03,;-.16,-7.45,;-.43,-4.78,;10.14,-6.55,;11.68,-6.55,;9.29,-7.83,;9.99,-9.2,;9.13,-10.49,;7.59,-10.4,;6.92,-9.01,;7.76,-7.73,)| Show InChI InChI=1S/C27H43N3O/c1-21(2)22-8-10-24(11-9-22)29-14-12-27(13-15-29)26-20-28(16-17-31)18-23(26)19-30(27)25-6-4-3-5-7-25/h3-7,21-24,26,31H,8-20H2,1-2H3/t22-,23-,24+,26-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 0.776 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50181073
(2-(3-chloro-benzyloxy)-6-methyl-isonicotinonitrile...)Show InChI InChI=1S/C14H11ClN2O/c1-10-5-12(8-16)7-14(17-10)18-9-11-3-2-4-13(15)6-11/h2-7H,9H2,1H3 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffman-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]MPEP from recombinant human mGlu5 receptor |
Bioorg Med Chem Lett 16: 1892-7 (2006)
Article DOI: 10.1016/j.bmcl.2005.12.088
BindingDB Entry DOI: 10.7270/Q2ZG6RT8 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371462
(CHEMBL258075)Show InChI InChI=1S/C12H17N3O/c1-7(2)16-10-6-4-5-9-8(3)14-12(13)15-11(9)10/h4-8H,1-3H3,(H3,13,14,15) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474322
(CHEMBL2112345)Show SMILES [H][C@]12CN(C)C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1 |wU:14.15,17.22,6.7,1.0,(17.01,-3.4,;15.89,-2.33,;17.15,-1.42,;16.68,.04,;17.59,1.28,;15.15,.05,;14.66,-1.42,;13.63,-.28,;13.4,-2.33,;12.77,-3.73,;11.26,-3.89,;10.35,-2.64,;10.98,-1.23,;12.49,-1.07,;8.81,-2.8,;7.9,-1.56,;6.37,-1.72,;5.74,-3.12,;6.65,-4.38,;8.18,-4.22,;4.2,-3.28,;3.57,-4.69,;3.32,-2.03,;13.89,-3.8,;15.43,-3.8,;13.05,-5.08,;13.73,-6.45,;12.89,-7.74,;11.35,-7.65,;10.65,-6.27,;11.51,-4.98,)| Show InChI InChI=1S/C26H41N3/c1-20(2)21-9-11-23(12-10-21)28-15-13-26(14-16-28)25-19-27(3)17-22(25)18-29(26)24-7-5-4-6-8-24/h4-8,20-23,25H,9-19H2,1-3H3/t21-,22-,23+,25-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474322
(CHEMBL2112345)Show SMILES [H][C@]12CN(C)C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1 |wU:14.15,17.22,6.7,1.0,(17.01,-3.4,;15.89,-2.33,;17.15,-1.42,;16.68,.04,;17.59,1.28,;15.15,.05,;14.66,-1.42,;13.63,-.28,;13.4,-2.33,;12.77,-3.73,;11.26,-3.89,;10.35,-2.64,;10.98,-1.23,;12.49,-1.07,;8.81,-2.8,;7.9,-1.56,;6.37,-1.72,;5.74,-3.12,;6.65,-4.38,;8.18,-4.22,;4.2,-3.28,;3.57,-4.69,;3.32,-2.03,;13.89,-3.8,;15.43,-3.8,;13.05,-5.08,;13.73,-6.45,;12.89,-7.74,;11.35,-7.65,;10.65,-6.27,;11.51,-4.98,)| Show InChI InChI=1S/C26H41N3/c1-20(2)21-9-11-23(12-10-21)28-15-13-26(14-16-28)25-19-27(3)17-22(25)18-29(26)24-7-5-4-6-8-24/h4-8,20-23,25H,9-19H2,1-3H3/t21-,22-,23+,25-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(RAT) | BDBM50371998
(CHEMBL404372)Show InChI InChI=1S/C9H10ClN3/c1-5-8-6(10)3-2-4-7(8)13-9(11)12-5/h2-5H,1H3,(H3,11,12,13)/t5-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to rat 5HT5A receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371998
(CHEMBL404372)Show InChI InChI=1S/C9H10ClN3/c1-5-8-6(10)3-2-4-7(8)13-9(11)12-5/h2-5H,1H3,(H3,11,12,13)/t5-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT5A receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474324
(CHEMBL2112346)Show SMILES [H][C@]12CN(CC3CC3)C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccc(F)cc1 |wU:17.19,20.26,9.11,1.0,(11.12,-5.64,;10.02,-4.57,;11.26,-3.66,;10.79,-2.21,;11.72,-.96,;13.24,-1.13,;14.47,-2.03,;14.65,-.51,;9.25,-2.2,;8.77,-3.66,;7.74,-2.52,;7.53,-4.57,;6.62,-3.32,;5.09,-3.48,;4.46,-4.89,;5.36,-6.13,;6.9,-5.97,;2.93,-5.05,;2.03,-3.8,;.5,-3.97,;-.13,-5.36,;.78,-6.62,;2.31,-6.46,;-1.67,-5.53,;-2.31,-6.94,;-2.58,-4.27,;8.01,-6.04,;9.55,-6.04,;7.16,-7.32,;5.62,-7.23,;4.78,-8.51,;5.46,-9.9,;4.69,-11.23,;6.99,-9.99,;7.86,-8.7,)| Show InChI InChI=1S/C29H44FN3/c1-21(2)23-5-9-26(10-6-23)32-15-13-29(14-16-32)28-20-31(17-22-3-4-22)18-24(28)19-33(29)27-11-7-25(30)8-12-27/h7-8,11-12,21-24,26,28H,3-6,9-10,13-20H2,1-2H3/t23-,24-,26+,28-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474326
(CHEMBL2112347)Show SMILES [H][C@]12CN(C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1)c1ccccc1 |wU:13.14,16.21,1.0,5.6,(10.85,-8.1,;9.73,-7.03,;10.99,-6.12,;10.52,-4.66,;8.99,-4.65,;8.5,-6.12,;7.48,-4.96,;7.26,-7.01,;6.63,-8.42,;5.1,-8.58,;4.2,-7.34,;4.82,-5.93,;6.35,-5.77,;2.66,-7.5,;1.75,-6.24,;.23,-6.41,;-.4,-7.8,;.51,-9.06,;2.03,-8.89,;-1.93,-7.96,;-2.57,-9.38,;-2.83,-6.72,;7.73,-8.48,;9.27,-8.48,;6.89,-9.75,;7.58,-11.14,;6.73,-12.43,;5.2,-12.34,;4.51,-10.94,;5.36,-9.66,;11.43,-3.4,;12.98,-3.59,;13.9,-2.33,;13.27,-.92,;11.72,-.75,;10.8,-2,)| Show InChI InChI=1S/C31H43N3/c1-24(2)25-13-15-28(16-14-25)32-19-17-31(18-20-32)30-23-33(27-9-5-3-6-10-27)21-26(30)22-34(31)29-11-7-4-8-12-29/h3-12,24-26,28,30H,13-23H2,1-2H3/t25-,26-,28+,30-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371981
(CHEMBL256694)Show SMILES C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c12 |c:8| Show InChI InChI=1S/C11H11Cl2F2N3/c1-5-9-7(3-2-6(12)10(9)13)18-11(17-5)16-4-8(14)15/h2-3,5,8H,4H2,1H3,(H2,16,17,18)/t5-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT5A receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371464
(CHEMBL273170)Show InChI InChI=1S/C9H9Cl2N3/c1-4-7-6(14-9(12)13-4)3-2-5(10)8(7)11/h2-4H,1H3,(H3,12,13,14) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474323
(CHEMBL2112341)Show SMILES [H][C@]12CN(CCN3CCOCC3)C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1 |wU:21.23,24.30,1.0,13.15,(8.25,-5.32,;7.14,-4.25,;8.39,-3.34,;7.92,-1.87,;8.84,-.63,;10.37,-.79,;11.27,.44,;10.67,1.86,;11.56,3.09,;13.1,2.93,;13.73,1.53,;12.81,.28,;6.38,-1.87,;5.89,-3.34,;4.87,-2.19,;4.64,-4.24,;3.73,-2.99,;2.21,-3.15,;1.58,-4.55,;2.49,-5.81,;4.01,-5.64,;.05,-4.71,;-.85,-3.47,;-2.39,-3.63,;-3.02,-5.04,;-2.11,-6.29,;-.57,-6.13,;-4.56,-5.19,;-5.45,-3.94,;-5.19,-6.6,;5.13,-5.71,;6.67,-5.71,;4.29,-6.99,;2.75,-6.89,;1.89,-8.16,;2.59,-9.56,;4.12,-9.65,;4.97,-8.37,)| Show InChI InChI=1S/C31H50N4O/c1-25(2)26-8-10-28(11-9-26)34-14-12-31(13-15-34)30-24-33(17-16-32-18-20-36-21-19-32)22-27(30)23-35(31)29-6-4-3-5-7-29/h3-7,25-28,30H,8-24H2,1-2H3/t26-,27-,28+,30-/m1/s1 | PDB
Reactome pathway
KEGG
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| PC cid
PC sid
UniChem
| Article
PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474325
(CHEMBL2112343)Show SMILES [H][C@]12CN(Cc3ccccc3)C[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1 |wU:20.22,23.29,12.14,1.0,(8.65,-5.09,;7.53,-4.02,;8.79,-3.11,;8.32,-1.64,;9.23,-.4,;10.77,-.56,;11.66,.68,;13.19,.51,;13.82,-.89,;12.91,-2.13,;11.38,-1.96,;6.79,-1.64,;6.3,-3.11,;5.27,-1.96,;5.06,-4.01,;4.43,-5.41,;2.9,-5.58,;1.99,-4.32,;2.62,-2.92,;4.15,-2.76,;.45,-4.48,;-.46,-3.24,;-1.98,-3.4,;-2.61,-4.81,;-1.7,-6.06,;-.18,-5.89,;-4.15,-4.96,;-5.05,-3.71,;-4.79,-6.37,;5.53,-5.47,;7.07,-5.47,;4.69,-6.76,;3.15,-6.66,;2.31,-7.93,;2.99,-9.33,;4.53,-9.42,;5.38,-8.14,)| Show InChI InChI=1S/C32H45N3/c1-25(2)27-13-15-29(16-14-27)34-19-17-32(18-20-34)31-24-33(21-26-9-5-3-6-10-26)22-28(31)23-35(32)30-11-7-4-8-12-30/h3-12,25,27-29,31H,13-24H2,1-2H3/t27-,28-,29+,31-/m1/s1 | PDB
Reactome pathway
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| PC cid
PC sid
UniChem
| Article
PubMed
| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
Nociceptin receptor
(Homo sapiens (Human)) | BDBM50474327
(CHEMBL2112344)Show SMILES [H][C@]12CNC[C@@]1([H])C1(CCN(CC1)[C@@H]1CC[C@@H](CC1)C(C)C)N(C2)c1ccccc1 |wU:13.14,16.21,1.0,5.6,(6.85,-4.97,;5.74,-3.9,;6.99,-2.99,;6.52,-1.52,;4.98,-1.52,;4.5,-2.99,;3.47,-1.84,;3.25,-3.89,;2.62,-5.29,;1.09,-5.46,;.19,-4.2,;.82,-2.8,;2.34,-2.64,;-1.34,-4.36,;-2.25,-3.12,;-3.79,-3.28,;-4.42,-4.69,;-3.51,-5.94,;-1.97,-5.78,;-5.95,-4.84,;-6.85,-3.59,;-6.58,-6.25,;3.73,-5.36,;5.27,-5.36,;2.89,-6.64,;1.35,-6.54,;.5,-7.81,;1.19,-9.21,;2.72,-9.3,;3.57,-8.02,)| Show InChI InChI=1S/C25H39N3/c1-19(2)20-8-10-22(11-9-20)27-14-12-25(13-15-27)24-17-26-16-21(24)18-28(25)23-6-4-3-5-7-23/h3-7,19-22,24,26H,8-18H2,1-2H3/t20-,21-,22+,24-/m1/s1 | PDB
Reactome pathway
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| PC cid
PC sid
UniChem
| Article
PubMed
| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibition of N/OFQ binding to human Orphanin FQ receptor (Nociceptin/Orphanin) |
J Med Chem 46: 255-64 (2003)
Article DOI: 10.1021/jm0209174
BindingDB Entry DOI: 10.7270/Q2GH9MQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371459
(CHEMBL272781)Show InChI InChI=1S/C9H9Cl2N3/c1-4-7-5(10)2-3-6(11)8(7)14-9(12)13-4/h2-4H,1H3,(H3,12,13,14) | PDB
Reactome pathway
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PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371461
(CHEMBL402179)Show InChI InChI=1S/C13H19N3O/c1-8(2)17-11-7-5-6-10-9(3)15-13(14-4)16-12(10)11/h5-9H,1-4H3,(H2,14,15,16) | PDB
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UniChem
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PubMed
| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371460
(CHEMBL401745)Show InChI InChI=1S/C11H14ClN3O/c1-5-7(12)4-8(16-3)10-9(5)6(2)14-11(13)15-10/h4,6H,1-3H3,(H3,13,14,15) | PDB
Reactome pathway
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PC sid
UniChem
| Article
PubMed
| 2.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50371981
(CHEMBL256694)Show SMILES C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c12 |c:8| Show InChI InChI=1S/C11H11Cl2F2N3/c1-5-9-7(3-2-6(12)10(9)13)18-11(17-5)16-4-8(14)15/h2-3,5,8H,4H2,1H3,(H2,16,17,18)/t5-/m0/s1 | PDB
Reactome pathway
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UniChem
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PubMed
| 2.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to histamine H1 receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(RAT) | BDBM50371996
(CHEMBL541993)Show InChI InChI=1S/C11H12ClF2N3/c1-6-10-7(12)3-2-4-8(10)17-11(16-6)15-5-9(13)14/h2-4,6,9H,5H2,1H3,(H2,15,16,17)/t6-/m0/s1 | PDB
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| 2.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to rat 5HT5A receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Rattus norvegicus (Rat)) | BDBM50084137
(2-Methyl-6-(phenylethynyl)pyridine | 2-Methyl-6-ph...)Show InChI InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3 | PDB
MMDB
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PubMed
| 3.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 315: 711-21 (2005)
Article DOI: 10.1124/jpet.105.089839
BindingDB Entry DOI: 10.7270/Q2BC3X4M |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50084137
(2-Methyl-6-(phenylethynyl)pyridine | 2-Methyl-6-ph...)Show InChI InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3 | PDB
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PubMed
| 3.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 315: 711-21 (2005)
Article DOI: 10.1124/jpet.105.089839
BindingDB Entry DOI: 10.7270/Q2BC3X4M |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371980
(CHEMBL446459)Show InChI InChI=1S/C14H19F2N3O/c1-8(2)20-11-6-4-5-10-9(3)18-14(19-13(10)11)17-7-12(15)16/h4-6,8-9,12H,7H2,1-3H3,(H2,17,18,19) | PDB
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| 4.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT7 receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50181066
(2-(3-(3-chlorobenzyloxy)-5-methylphenyl)isoindolin...)Show SMILES Cc1cc(OCc2cccc(Cl)c2)cc(c1)N1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C22H16ClNO3/c1-14-9-17(24-21(25)19-7-2-3-8-20(19)22(24)26)12-18(10-14)27-13-15-5-4-6-16(23)11-15/h2-12H,13H2,1H3 | PDB
MMDB
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UniChem
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PubMed
| 4.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffman-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]MPEP from recombinant human mGlu5 receptor |
Bioorg Med Chem Lett 16: 1892-7 (2006)
Article DOI: 10.1016/j.bmcl.2005.12.088
BindingDB Entry DOI: 10.7270/Q2ZG6RT8 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371460
(CHEMBL401745)Show InChI InChI=1S/C11H14ClN3O/c1-5-7(12)4-8(16-3)10-9(5)6(2)14-11(13)15-10/h4,6H,1-3H3,(H3,13,14,15) | PDB
KEGG
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| CHEMBL
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PC sid
UniChem
| Article
PubMed
| 4.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50181075
(2-(3-chlorobenzyloxy)-6-chloroisonicotinonitrile |...)Show InChI InChI=1S/C13H8Cl2N2O/c14-11-3-1-2-9(4-11)8-18-13-6-10(7-16)5-12(15)17-13/h1-6H,8H2 | PDB
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PC sid
UniChem
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PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffman-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]MPEP from recombinant human mGlu5 receptor |
Bioorg Med Chem Lett 16: 1892-7 (2006)
Article DOI: 10.1016/j.bmcl.2005.12.088
BindingDB Entry DOI: 10.7270/Q2ZG6RT8 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371466
(CHEMBL270177)Show InChI InChI=1S/C9H10ClN3/c1-5-8-6(10)3-2-4-7(8)13-9(11)12-5/h2-5H,1H3,(H3,11,12,13) | PDB
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| CHEMBL
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PC sid
UniChem
Similars
| Article
PubMed
| 5.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50122758
(2-methyl-4-(pyridin-3-ylethynyl)thiazole | 3-(2-(2...)Show InChI InChI=1S/C11H8N2S/c1-9-13-11(8-14-9)5-4-10-3-2-6-12-7-10/h2-3,6-8H,1H3 | PDB
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PubMed
| 5.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 315: 711-21 (2005)
Article DOI: 10.1124/jpet.105.089839
BindingDB Entry DOI: 10.7270/Q2BC3X4M |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Rattus norvegicus (Rat)) | BDBM50122758
(2-methyl-4-(pyridin-3-ylethynyl)thiazole | 3-(2-(2...)Show InChI InChI=1S/C11H8N2S/c1-9-13-11(8-14-9)5-4-10-3-2-6-12-7-10/h2-3,6-8H,1H3 | PDB
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| 5.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 315: 711-21 (2005)
Article DOI: 10.1124/jpet.105.089839
BindingDB Entry DOI: 10.7270/Q2BC3X4M |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371974
(CHEMBL256047)Show SMILES C[C@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c12 |c:8| Show InChI InChI=1S/C11H11Cl2F2N3/c1-5-9-7(3-2-6(12)10(9)13)18-11(17-5)16-4-8(14)15/h2-3,5,8H,4H2,1H3,(H2,16,17,18)/t5-/m1/s1 | PDB
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PubMed
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT5A receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50181076
(3-((3-(1,3-dioxoisoindolin-2-yl)-5-methylphenoxy)m...)Show SMILES Cc1cc(OCc2cccc(c2)C#N)cc(c1)N1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C23H16N2O3/c1-15-9-18(25-22(26)20-7-2-3-8-21(20)23(25)27)12-19(10-15)28-14-17-6-4-5-16(11-17)13-24/h2-12H,14H2,1H3 | PDB
MMDB
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffman-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]MPEP from recombinant human mGlu5 receptor |
Bioorg Med Chem Lett 16: 1892-7 (2006)
Article DOI: 10.1016/j.bmcl.2005.12.088
BindingDB Entry DOI: 10.7270/Q2ZG6RT8 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371998
(CHEMBL404372)Show InChI InChI=1S/C9H10ClN3/c1-5-8-6(10)3-2-4-7(8)13-9(11)12-5/h2-5H,1H3,(H3,11,12,13)/t5-/m0/s1 | PDB
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| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT7 receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371445
(CHEMBL408152)Show InChI InChI=1S/C10H13N3O/c1-6-7-4-3-5-8(14-2)9(7)13-10(11)12-6/h3-6H,1-2H3,(H3,11,12,13) | PDB
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| 6.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371463
(CHEMBL271298)Show InChI InChI=1S/C10H11Cl2N3/c1-5-8-7(15-10(13-2)14-5)4-3-6(11)9(8)12/h3-5H,1-2H3,(H2,13,14,15) | PDB
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UniChem
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PubMed
| 6.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371459
(CHEMBL272781)Show InChI InChI=1S/C9H9Cl2N3/c1-4-7-5(10)2-3-6(11)8(7)14-9(12)13-4/h2-4H,1H3,(H3,12,13,14) | PDB
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PubMed
| 6.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50084137
(2-Methyl-6-(phenylethynyl)pyridine | 2-Methyl-6-ph...)Show InChI InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3 | PDB
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PubMed
| 6.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 315: 711-21 (2005)
Article DOI: 10.1124/jpet.105.089839
BindingDB Entry DOI: 10.7270/Q2BC3X4M |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371996
(CHEMBL541993)Show InChI InChI=1S/C11H12ClF2N3/c1-6-10-7(12)3-2-4-8(10)17-11(16-6)15-5-9(13)14/h2-4,6,9H,5H2,1H3,(H2,15,16,17)/t6-/m0/s1 | PDB
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| 6.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT5A receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371981
(CHEMBL256694)Show SMILES C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c12 |c:8| Show InChI InChI=1S/C11H11Cl2F2N3/c1-5-9-7(3-2-6(12)10(9)13)18-11(17-5)16-4-8(14)15/h2-3,5,8H,4H2,1H3,(H2,16,17,18)/t5-/m0/s1 | PDB
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| 7.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT7 receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50371464
(CHEMBL273170)Show InChI InChI=1S/C9H9Cl2N3/c1-4-7-6(14-9(12)13-4)3-2-5(10)8(7)11/h2-4H,1H3,(H3,12,13,14) | PDB
Reactome pathway
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UniChem
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PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to histamine H1 receptor |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371445
(CHEMBL408152)Show InChI InChI=1S/C10H13N3O/c1-6-7-4-3-5-8(14-2)9(7)13-10(11)12-6/h3-6H,1-2H3,(H3,11,12,13) | PDB
Reactome pathway
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UniChem
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PubMed
| 8.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50371464
(CHEMBL273170)Show InChI InChI=1S/C9H9Cl2N3/c1-4-7-6(14-9(12)13-4)3-2-5(10)8(7)11/h2-4H,1H3,(H3,12,13,14) | PDB
Reactome pathway
KEGG
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| CHEMBL
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PC sid
UniChem
Similars
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PubMed
| 8.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Rattus norvegicus (Rat)) | BDBM50084137
(2-Methyl-6-(phenylethynyl)pyridine | 2-Methyl-6-ph...)Show InChI InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3 | PDB
MMDB
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PubMed
| 8.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 315: 711-21 (2005)
Article DOI: 10.1124/jpet.105.089839
BindingDB Entry DOI: 10.7270/Q2BC3X4M |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50181067
(2-chloro-6-((2-methylpyridin-4-yl)methoxy)isonicot...)Show InChI InChI=1S/C13H10ClN3O/c1-9-4-10(2-3-16-9)8-18-13-6-11(7-15)5-12(14)17-13/h2-6H,8H2,1H3 | PDB
MMDB
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UniChem
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PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffman-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]MPEP from recombinant human mGlu5 receptor |
Bioorg Med Chem Lett 16: 1892-7 (2006)
Article DOI: 10.1016/j.bmcl.2005.12.088
BindingDB Entry DOI: 10.7270/Q2ZG6RT8 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371462
(CHEMBL258075)Show InChI InChI=1S/C12H17N3O/c1-7(2)16-10-6-4-5-9-8(3)14-12(13)15-11(9)10/h4-8H,1-3H3,(H3,13,14,15) | PDB
KEGG
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| CHEMBL
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UniChem
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PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371985
(CHEMBL404511)Show InChI InChI=1S/C11H12ClF2N3/c1-6-10-7(12)3-2-4-8(10)17-11(16-6)15-5-9(13)14/h2-4,6,9H,5H2,1H3,(H2,15,16,17) | PDB
KEGG
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UniChem
Similars
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PubMed
| 10.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Binding affinity to human 5HT5A receptor |
Bioorg Med Chem Lett 18: 262-6 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.078
BindingDB Entry DOI: 10.7270/Q2FJ2HNN |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 5A
(Homo sapiens (Human)) | BDBM50371465
(CHEMBL269964)Show InChI InChI=1S/C10H12ClN3/c1-6-9-7(11)4-3-5-8(9)14-10(12-2)13-6/h3-6H,1-2H3,(H2,12,13,14) | PDB
KEGG
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UniChem
Similars
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PubMed
| 10.8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from human recombinant 5HT5A receptor expressed in HEK293-EBNA cells |
Bioorg Med Chem Lett 18: 256-61 (2008)
Article DOI: 10.1016/j.bmcl.2007.10.080
BindingDB Entry DOI: 10.7270/Q2KD1ZQD |
More data for this
Ligand-Target Pair | |
Metabotropic glutamate receptor 5
(Homo sapiens (Human)) | BDBM50181079
(CHEMBL207097 | N-(2-(3-chlorobenzyloxy)-6-methylpy...)Show InChI InChI=1S/C18H17ClN4O/c1-13-6-16(23(2)17-9-20-12-21-10-17)8-18(22-13)24-11-14-4-3-5-15(19)7-14/h3-10,12H,11H2,1-2H3 | PDB
MMDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffman-La Roche Ltd
Curated by ChEMBL
| Assay Description
Displacement of [3H]MPEP from recombinant human mGlu5 receptor |
Bioorg Med Chem Lett 16: 1892-7 (2006)
Article DOI: 10.1016/j.bmcl.2005.12.088
BindingDB Entry DOI: 10.7270/Q2ZG6RT8 |
More data for this
Ligand-Target Pair | |
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