Found 68 hits of Enzyme Inhibition Constant Data 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 |
|---|
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373781
(CHEMBL257252)Show SMILES Fc1cccc(-c2cc(NC(=O)N3CCC(CC3)n3c4cccnc4[nH]c3=O)c(=O)n(CC(F)(F)F)c2)c1F Show InChI InChI=1S/C25H21F5N6O3/c26-17-4-1-3-16(20(17)27)14-11-18(22(37)35(12-14)13-25(28,29)30)32-23(38)34-9-6-15(7-10-34)36-19-5-2-8-31-21(19)33-24(36)39/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,32,38)(H,31,33,39) | PDB
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| Article
PubMed
| 17 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373777
(CHEMBL257094)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(F)c1F Show InChI InChI=1S/C26H26F2N6O4/c1-38-13-12-33-15-16(18-4-2-5-19(27)22(18)28)14-20(24(33)35)30-25(36)32-10-7-17(8-11-32)34-21-6-3-9-29-23(21)31-26(34)37/h2-6,9,14-15,17H,7-8,10-13H2,1H3,(H,30,36)(H,29,31,37) | PDB
UniProtKB/SwissProt
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UniChem
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PubMed
| 41 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373794
(CHEMBL270175)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(O)c1 Show InChI InChI=1S/C24H24N6O4/c1-28-14-16(15-4-2-5-18(31)12-15)13-19(22(28)32)26-23(33)29-10-7-17(8-11-29)30-20-6-3-9-25-21(20)27-24(30)34/h2-6,9,12-14,17,31H,7-8,10-11H2,1H3,(H,26,33)(H,25,27,34) | PDB
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| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373782
(CHEMBL256901)Show SMILES Fc1cccc(c1)-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(CC(F)(F)F)c1 Show InChI InChI=1S/C25H22F4N6O3/c26-17-4-1-3-15(11-17)16-12-19(22(36)34(13-16)14-25(27,28)29)31-23(37)33-9-6-18(7-10-33)35-20-5-2-8-30-21(20)32-24(35)38/h1-5,8,11-13,18H,6-7,9-10,14H2,(H,31,37)(H,30,32,38) | PDB
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| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373793
(CHEMBL270390)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccc(O)cc1 Show InChI InChI=1S/C24H24N6O4/c1-28-14-16(15-4-6-18(31)7-5-15)13-19(22(28)32)26-23(33)29-11-8-17(9-12-29)30-20-3-2-10-25-21(20)27-24(30)34/h2-7,10,13-14,17,31H,8-9,11-12H2,1H3,(H,26,33)(H,25,27,34) | PDB
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| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373770
(CHEMBL428247)Show SMILES Fc1ccccc1-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(CC(F)(F)F)c1 Show InChI InChI=1S/C25H22F4N6O3/c26-18-5-2-1-4-17(18)15-12-19(22(36)34(13-15)14-25(27,28)29)31-23(37)33-10-7-16(8-11-33)35-20-6-3-9-30-21(20)32-24(35)38/h1-6,9,12-13,16H,7-8,10-11,14H2,(H,31,37)(H,30,32,38) | PDB
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| Article
PubMed
| 54 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373778
(CHEMBL257902)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)C1C=CN=N1 |c:32,34| Show InChI InChI=1S/C21H22N8O3/c1-27-12-13(15-4-8-23-26-15)11-16(19(27)30)24-20(31)28-9-5-14(6-10-28)29-17-3-2-7-22-18(17)25-21(29)32/h2-4,7-8,11-12,14-15H,5-6,9-10H2,1H3,(H,24,31)(H,22,25,32) | PDB
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PubMed
| 71 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373772
(CHEMBL270796)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccc(O)cc1 Show InChI InChI=1S/C26H28N6O5/c1-37-14-13-31-16-18(17-4-6-20(33)7-5-17)15-21(24(31)34)28-25(35)30-11-8-19(9-12-30)32-22-3-2-10-27-23(22)29-26(32)36/h2-7,10,15-16,19,33H,8-9,11-14H2,1H3,(H,28,35)(H,27,29,36) | PDB
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| 74 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373774
(CHEMBL257731)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccsc1 Show InChI InChI=1S/C22H22N6O3S/c1-26-12-15(14-6-10-32-13-14)11-17(20(26)29)24-21(30)27-8-4-16(5-9-27)28-18-3-2-7-23-19(18)25-22(28)31/h2-3,6-7,10-13,16H,4-5,8-9H2,1H3,(H,24,30)(H,23,25,31) | PDB
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| 75 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373776
(CHEMBL256203)Show SMILES O=C(Nc1cc(cn(CC2CC2)c1=O)-c1ccccc1)N1CCC(CC1)n1cc([nH]c1=O)-c1ccccc1 Show InChI InChI=1S/C30H31N5O3/c36-28-26(17-24(22-7-3-1-4-8-22)19-34(28)18-21-11-12-21)31-29(37)33-15-13-25(14-16-33)35-20-27(32-30(35)38)23-9-5-2-6-10-23/h1-10,17,19-21,25H,11-16,18H2,(H,31,37)(H,32,38) | PDB
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| 80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373786
(CHEMBL255966)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1 Show InChI InChI=1S/C25H23F3N6O3/c26-25(27,28)15-33-14-17(16-5-2-1-3-6-16)13-19(22(33)35)30-23(36)32-11-8-18(9-12-32)34-20-7-4-10-29-21(20)31-24(34)37/h1-7,10,13-14,18H,8-9,11-12,15H2,(H,30,36)(H,29,31,37) | PDB
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| 95 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373783
(CHEMBL255136)Show SMILES Oc1ccc(cc1)-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(CC(F)(F)F)c1 Show InChI InChI=1S/C25H23F3N6O4/c26-25(27,28)14-33-13-16(15-3-5-18(35)6-4-15)12-19(22(33)36)30-23(37)32-10-7-17(8-11-32)34-20-2-1-9-29-21(20)31-24(34)38/h1-6,9,12-13,17,35H,7-8,10-11,14H2,(H,30,37)(H,29,31,38) | PDB
UniProtKB/SwissProt
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PC sid
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| Article
PubMed
| 96 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373771
(CHEMBL255967)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccsc1 Show InChI InChI=1S/C23H21F3N6O3S/c24-23(25,26)13-31-11-15(14-5-9-36-12-14)10-17(20(31)33)28-21(34)30-7-3-16(4-8-30)32-18-2-1-6-27-19(18)29-22(32)35/h1-2,5-6,9-12,16H,3-4,7-8,13H2,(H,28,34)(H,27,29,35) | PDB
UniProtKB/SwissProt
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| Article
PubMed
| 105 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373787
(CHEMBL255998)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C23H26N8O4/c1-35-12-11-30-14-15(17-4-8-25-28-17)13-18(21(30)32)26-22(33)29-9-5-16(6-10-29)31-19-3-2-7-24-20(19)27-23(31)34/h2-4,7-8,13-14,16H,5-6,9-12H2,1H3,(H,25,28)(H,26,33)(H,24,27,34) | PDB
UniProtKB/SwissProt
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| Article
PubMed
| 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373791
(CHEMBL258329)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(F)c1 Show InChI InChI=1S/C24H23FN6O3/c1-29-14-16(15-4-2-5-17(25)12-15)13-19(22(29)32)27-23(33)30-10-7-18(8-11-30)31-20-6-3-9-26-21(20)28-24(31)34/h2-6,9,12-14,18H,7-8,10-11H2,1H3,(H,27,33)(H,26,28,34) | PDB
UniProtKB/SwissProt
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Similars
| Article
PubMed
| 155 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373790
(CHEMBL445069)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(F)c1F Show InChI InChI=1S/C24H22F2N6O3/c1-30-13-14(16-4-2-5-17(25)20(16)26)12-18(22(30)33)28-23(34)31-10-7-15(8-11-31)32-19-6-3-9-27-21(19)29-24(32)35/h2-6,9,12-13,15H,7-8,10-11H2,1H3,(H,28,34)(H,27,29,35) | PDB
UniProtKB/SwissProt
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PC sid
UniChem
Similars
| Article
PubMed
| 166 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373780
(CHEMBL403765)Show SMILES O=C(Nc1cc(cn(CC2CC2)c1=O)-c1ccccc1)N1CCC(CC1)n1c2cccnc2[nH]c1=O Show InChI InChI=1S/C27H28N6O3/c34-25-22(15-20(19-5-2-1-3-6-19)17-32(25)16-18-8-9-18)29-26(35)31-13-10-21(11-14-31)33-23-7-4-12-28-24(23)30-27(33)36/h1-7,12,15,17-18,21H,8-11,13-14,16H2,(H,29,35)(H,28,30,36) | PDB
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 170 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373784
(CHEMBL402887)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C22H21F3N8O3/c23-22(24,25)12-32-11-13(15-3-7-27-30-15)10-16(19(32)34)28-20(35)31-8-4-14(5-9-31)33-17-2-1-6-26-18(17)29-21(33)36/h1-3,6-7,10-11,14H,4-5,8-9,12H2,(H,27,30)(H,28,35)(H,26,29,36) | PDB
UniProtKB/SwissProt
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 205 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373792
(CHEMBL257732)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1F Show InChI InChI=1S/C24H23FN6O3/c1-29-14-15(17-5-2-3-6-18(17)25)13-19(22(29)32)27-23(33)30-11-8-16(9-12-30)31-20-7-4-10-26-21(20)28-24(31)34/h2-7,10,13-14,16H,8-9,11-12H2,1H3,(H,27,33)(H,26,28,34) | PDB
UniProtKB/SwissProt
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PubMed
| 213 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373767
(CHEMBL270392)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1O Show InChI InChI=1S/C24H24N6O4/c1-28-14-15(17-5-2-3-7-20(17)31)13-18(22(28)32)26-23(33)29-11-8-16(9-12-29)30-19-6-4-10-25-21(19)27-24(30)34/h2-7,10,13-14,16,31H,8-9,11-12H2,1H3,(H,26,33)(H,25,27,34) | PDB
UniProtKB/SwissProt
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PubMed
| 220 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373773
(CHEMBL402844)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1 Show InChI InChI=1S/C26H28N6O4/c1-36-15-14-31-17-19(18-6-3-2-4-7-18)16-21(24(31)33)28-25(34)30-12-9-20(10-13-30)32-22-8-5-11-27-23(22)29-26(32)35/h2-8,11,16-17,20H,9-10,12-15H2,1H3,(H,28,34)(H,27,29,35) | PDB
UniProtKB/SwissProt
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PubMed
| 228 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373766
(CHEMBL403373)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccnc1 Show InChI InChI=1S/C23H23N7O3/c1-28-14-16(15-4-2-8-24-13-15)12-18(21(28)31)26-22(32)29-10-6-17(7-11-29)30-19-5-3-9-25-20(19)27-23(30)33/h2-5,8-9,12-14,17H,6-7,10-11H2,1H3,(H,26,32)(H,25,27,33) | PDB
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PubMed
| 270 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373789
(CHEMBL256813)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccsc1 Show InChI InChI=1S/C24H26N6O4S/c1-34-11-10-29-14-17(16-6-12-35-15-16)13-19(22(29)31)26-23(32)28-8-4-18(5-9-28)30-20-3-2-7-25-21(20)27-24(30)33/h2-3,6-7,12-15,18H,4-5,8-11H2,1H3,(H,26,32)(H,25,27,33) | PDB
UniProtKB/SwissProt
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PC sid
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| Article
PubMed
| 390 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373775
(CHEMBL256802)Show SMILES COc1ccc(cc1)-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(C)c1 Show InChI InChI=1S/C25H26N6O4/c1-29-15-17(16-5-7-19(35-2)8-6-16)14-20(23(29)32)27-24(33)30-12-9-18(10-13-30)31-21-4-3-11-26-22(21)28-25(31)34/h3-8,11,14-15,18H,9-10,12-13H2,1-2H3,(H,27,33)(H,26,28,34) | PDB
UniProtKB/SwissProt
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PC sid
UniChem
Similars
| Article
PubMed
| 495 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373779
(CHEMBL258070)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1 Show InChI InChI=1S/C24H24N6O3/c1-28-15-17(16-6-3-2-4-7-16)14-19(22(28)31)26-23(32)29-12-9-18(10-13-29)30-20-8-5-11-25-21(20)27-24(30)33/h2-8,11,14-15,18H,9-10,12-13H2,1H3,(H,26,32)(H,25,27,33) | PDB
UniProtKB/SwissProt
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PC sid
UniChem
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| Article
PubMed
| 498 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373785
(CHEMBL255755)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccnc1 Show InChI InChI=1S/C24H22F3N7O3/c25-24(26,27)14-33-13-16(15-3-1-7-28-12-15)11-18(21(33)35)30-22(36)32-9-5-17(6-10-32)34-19-4-2-8-29-20(19)31-23(34)37/h1-4,7-8,11-13,17H,5-6,9-10,14H2,(H,30,36)(H,29,31,37) | PDB
UniProtKB/SwissProt
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PC sid
UniChem
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| Article
PubMed
| 635 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373788
(CHEMBL255999)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccnc1 Show InChI InChI=1S/C25H27N7O4/c1-36-13-12-31-16-18(17-4-2-8-26-15-17)14-20(23(31)33)28-24(34)30-10-6-19(7-11-30)32-21-5-3-9-27-22(21)29-25(32)35/h2-5,8-9,14-16,19H,6-7,10-13H2,1H3,(H,28,34)(H,27,29,35) | PDB
UniProtKB/SwissProt
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 695 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373795
(CHEMBL409535)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C25H26N6O5S/c1-29-15-17(16-5-7-19(8-6-16)37(2,35)36)14-20(23(29)32)27-24(33)30-12-9-18(10-13-30)31-21-4-3-11-26-22(21)28-25(31)34/h3-8,11,14-15,18H,9-10,12-13H2,1-2H3,(H,27,33)(H,26,28,34) | PDB
UniProtKB/SwissProt
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PC cid
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UniChem
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PubMed
| 1.75E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373768
(CHEMBL258069)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ncccn1 Show InChI InChI=1S/C22H22N8O3/c1-28-13-14(18-23-8-3-9-24-18)12-16(20(28)31)26-21(32)29-10-5-15(6-11-29)30-17-4-2-7-25-19(17)27-22(30)33/h2-4,7-9,12-13,15H,5-6,10-11H2,1H3,(H,26,32)(H,25,27,33) | PDB
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PubMed
| 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373796
(CHEMBL411896)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)C1C=NC=N1 |c:32,34| Show InChI InChI=1S/C21H22N8O3/c1-27-11-13(16-10-22-12-24-16)9-15(19(27)30)25-20(31)28-7-4-14(5-8-28)29-17-3-2-6-23-18(17)26-21(29)32/h2-3,6,9-12,14,16H,4-5,7-8H2,1H3,(H,25,31)(H,23,26,32) | PDB
UniProtKB/SwissProt
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PubMed
| 2.05E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373769
(CHEMBL402888)Show SMILES O=C(Nc1ccc(-c2ccccc2)n(CC2CC2)c1=O)N1CCC(CC1)n1cc([nH]c1=O)-c1ccccc1 Show InChI InChI=1S/C30H31N5O3/c36-28-25(13-14-27(23-9-5-2-6-10-23)35(28)19-21-11-12-21)31-29(37)33-17-15-24(16-18-33)34-20-26(32-30(34)38)22-7-3-1-4-8-22/h1-10,13-14,20-21,24H,11-12,15-19H2,(H,31,37)(H,32,38) | PDB
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PubMed
| 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373797
(CHEMBL257004)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccc(cc1)C(O)=O Show InChI InChI=1S/C25H24N6O5/c1-29-14-17(15-4-6-16(7-5-15)23(33)34)13-19(22(29)32)27-24(35)30-11-8-18(9-12-30)31-20-3-2-10-26-21(20)28-25(31)36/h2-7,10,13-14,18H,8-9,11-12H2,1H3,(H,27,35)(H,33,34)(H,26,28,36) | PDB
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PC sid
UniChem
Similars
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PubMed
| 9.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [125I]CGRP from human recombinant CL receptor /RAMP1 |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373781
(CHEMBL257252)Show SMILES Fc1cccc(-c2cc(NC(=O)N3CCC(CC3)n3c4cccnc4[nH]c3=O)c(=O)n(CC(F)(F)F)c2)c1F Show InChI InChI=1S/C25H21F5N6O3/c26-17-4-1-3-16(20(17)27)14-11-18(22(37)35(12-14)13-25(28,29)30)32-23(38)34-9-6-15(7-10-34)36-19-5-2-8-31-21(19)33-24(36)39/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,32,38)(H,31,33,39) | PDB
UniProtKB/SwissProt
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PC cid
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373793
(CHEMBL270390)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccc(O)cc1 Show InChI InChI=1S/C24H24N6O4/c1-28-14-16(15-4-6-18(31)7-5-15)13-19(22(28)32)26-23(33)29-11-8-17(9-12-29)30-20-3-2-10-25-21(20)27-24(30)34/h2-7,10,13-14,17,31H,8-9,11-12H2,1H3,(H,26,33)(H,25,27,34) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 88 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373782
(CHEMBL256901)Show SMILES Fc1cccc(c1)-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(CC(F)(F)F)c1 Show InChI InChI=1S/C25H22F4N6O3/c26-17-4-1-3-15(11-17)16-12-19(22(36)34(13-16)14-25(27,28)29)31-23(37)33-9-6-18(7-10-33)35-20-5-2-8-30-21(20)32-24(35)38/h1-5,8,11-13,18H,6-7,9-10,14H2,(H,31,37)(H,30,32,38) | PDB
UniProtKB/SwissProt
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GoogleScholar
AffyNet
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 119 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373794
(CHEMBL270175)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(O)c1 Show InChI InChI=1S/C24H24N6O4/c1-28-14-16(15-4-2-5-18(31)12-15)13-19(22(28)32)26-23(33)29-10-7-17(8-11-29)30-20-6-3-9-25-21(20)27-24(30)34/h2-6,9,12-14,17,31H,7-8,10-11H2,1H3,(H,26,33)(H,25,27,34) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 142 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373777
(CHEMBL257094)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(F)c1F Show InChI InChI=1S/C26H26F2N6O4/c1-38-13-12-33-15-16(18-4-2-5-19(27)22(18)28)14-20(24(33)35)30-25(36)32-10-7-17(8-11-32)34-21-6-3-9-29-23(21)31-26(34)37/h2-6,9,14-15,17H,7-8,10-13H2,1H3,(H,30,36)(H,29,31,37) | PDB
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| n/a | n/a | 164 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373772
(CHEMBL270796)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccc(O)cc1 Show InChI InChI=1S/C26H28N6O5/c1-37-14-13-31-16-18(17-4-6-20(33)7-5-17)15-21(24(31)34)28-25(35)30-11-8-19(9-12-30)32-22-3-2-10-27-23(22)29-26(32)36/h2-7,10,15-16,19,33H,8-9,11-14H2,1H3,(H,28,35)(H,27,29,36) | PDB
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| n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373778
(CHEMBL257902)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)C1C=CN=N1 |c:32,34| Show InChI InChI=1S/C21H22N8O3/c1-27-12-13(15-4-8-23-26-15)11-16(19(27)30)24-20(31)28-9-5-14(6-10-28)29-17-3-2-7-22-18(17)25-21(29)32/h2-4,7-8,11-12,14-15H,5-6,9-10H2,1H3,(H,24,31)(H,22,25,32) | PDB
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| n/a | n/a | 184 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373770
(CHEMBL428247)Show SMILES Fc1ccccc1-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(CC(F)(F)F)c1 Show InChI InChI=1S/C25H22F4N6O3/c26-18-5-2-1-4-17(18)15-12-19(22(36)34(13-15)14-25(27,28)29)31-23(37)33-10-7-16(8-11-33)35-20-6-3-9-30-21(20)32-24(35)38/h1-6,9,12-13,16H,7-8,10-11,14H2,(H,31,37)(H,30,32,38) | PDB
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| n/a | n/a | 186 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373786
(CHEMBL255966)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1 Show InChI InChI=1S/C25H23F3N6O3/c26-25(27,28)15-33-14-17(16-5-2-1-3-6-16)13-19(22(33)35)30-23(36)32-11-8-18(9-12-32)34-20-7-4-10-29-21(20)31-24(34)37/h1-7,10,13-14,18H,8-9,11-12,15H2,(H,30,36)(H,29,31,37) | PDB
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| n/a | n/a | 209 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373772
(CHEMBL270796)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccc(O)cc1 Show InChI InChI=1S/C26H28N6O5/c1-37-14-13-31-16-18(17-4-6-20(33)7-5-17)15-21(24(31)34)28-25(35)30-11-8-19(9-12-30)32-22-3-2-10-27-23(22)29-26(32)36/h2-7,10,15-16,19,33H,8-9,11-14H2,1H3,(H,28,35)(H,27,29,36) | PDB
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| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373783
(CHEMBL255136)Show SMILES Oc1ccc(cc1)-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(CC(F)(F)F)c1 Show InChI InChI=1S/C25H23F3N6O4/c26-25(27,28)14-33-13-16(15-3-5-18(35)6-4-15)12-19(22(33)36)30-23(37)32-10-7-17(8-11-32)34-20-2-1-9-29-21(20)31-24(34)38/h1-6,9,12-13,17,35H,7-8,10-11,14H2,(H,30,37)(H,29,31,38) | PDB
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| n/a | n/a | 282 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373780
(CHEMBL403765)Show SMILES O=C(Nc1cc(cn(CC2CC2)c1=O)-c1ccccc1)N1CCC(CC1)n1c2cccnc2[nH]c1=O Show InChI InChI=1S/C27H28N6O3/c34-25-22(15-20(19-5-2-1-3-6-19)17-32(25)16-18-8-9-18)29-26(35)31-13-10-21(11-14-31)33-23-7-4-12-28-24(23)30-27(33)36/h1-7,12,15,17-18,21H,8-11,13-14,16H2,(H,29,35)(H,28,30,36) | PDB
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| n/a | n/a | 302 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373787
(CHEMBL255998)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C23H26N8O4/c1-35-12-11-30-14-15(17-4-8-25-28-17)13-18(21(30)32)26-22(33)29-9-5-16(6-10-29)31-19-3-2-7-24-20(19)27-23(31)34/h2-4,7-8,13-14,16H,5-6,9-12H2,1H3,(H,25,28)(H,26,33)(H,24,27,34) | PDB
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| n/a | n/a | 307 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373774
(CHEMBL257731)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccsc1 Show InChI InChI=1S/C22H22N6O3S/c1-26-12-15(14-6-10-32-13-14)11-17(20(26)29)24-21(30)27-8-4-16(5-9-27)28-18-3-2-7-23-19(18)25-22(28)31/h2-3,6-7,10-13,16H,4-5,8-9H2,1H3,(H,24,30)(H,23,25,31) | PDB
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| n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373791
(CHEMBL258329)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(F)c1 Show InChI InChI=1S/C24H23FN6O3/c1-29-14-16(15-4-2-5-17(25)12-15)13-19(22(29)32)27-23(33)30-10-7-18(8-11-30)31-20-6-3-9-26-21(20)28-24(31)34/h2-6,9,12-14,18H,7-8,10-11H2,1H3,(H,27,33)(H,26,28,34) | PDB
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| n/a | n/a | 337 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373771
(CHEMBL255967)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccsc1 Show InChI InChI=1S/C23H21F3N6O3S/c24-23(25,26)13-31-11-15(14-5-9-36-12-14)10-17(20(31)33)28-21(34)30-7-3-16(4-8-30)32-18-2-1-6-27-19(18)29-22(32)35/h1-2,5-6,9-12,16H,3-4,7-8,13H2,(H,28,34)(H,27,29,35) | PDB
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| n/a | n/a | 345 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373776
(CHEMBL256203)Show SMILES O=C(Nc1cc(cn(CC2CC2)c1=O)-c1ccccc1)N1CCC(CC1)n1cc([nH]c1=O)-c1ccccc1 Show InChI InChI=1S/C30H31N5O3/c36-28-26(17-24(22-7-3-1-4-8-22)19-34(28)18-21-11-12-21)31-29(37)33-15-13-25(14-16-33)35-20-27(32-30(35)38)23-9-5-2-6-10-23/h1-10,17,19-21,25H,11-16,18H2,(H,31,37)(H,32,38) | PDB
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| n/a | n/a | 360 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373787
(CHEMBL255998)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C23H26N8O4/c1-35-12-11-30-14-15(17-4-8-25-28-17)13-18(21(30)32)26-22(33)29-9-5-16(6-10-29)31-19-3-2-7-24-20(19)27-23(31)34/h2-4,7-8,13-14,16H,5-6,9-12H2,1H3,(H,25,28)(H,26,33)(H,24,27,34) | PDB
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| n/a | n/a | 394 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373792
(CHEMBL257732)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1F Show InChI InChI=1S/C24H23FN6O3/c1-29-14-15(17-5-2-3-6-18(17)25)13-19(22(29)32)27-23(33)30-11-8-16(9-12-30)31-20-7-4-10-26-21(20)28-24(31)34/h2-7,10,13-14,16H,8-9,11-12H2,1H3,(H,27,33)(H,26,28,34) | PDB
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| n/a | n/a | 477 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373779
(CHEMBL258070)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1 Show InChI InChI=1S/C24H24N6O3/c1-28-15-17(16-6-3-2-4-7-16)14-19(22(28)31)26-23(32)29-12-9-18(10-13-29)30-20-8-5-11-25-21(20)27-24(30)33/h2-8,11,14-15,18H,9-10,12-13H2,1H3,(H,26,32)(H,25,27,33) | PDB
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| n/a | n/a | 495 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373789
(CHEMBL256813)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccsc1 Show InChI InChI=1S/C24H26N6O4S/c1-34-11-10-29-14-17(16-6-12-35-15-16)13-19(22(29)31)26-23(32)28-8-4-18(5-9-28)30-20-3-2-7-25-21(20)27-24(30)33/h2-3,6-7,12-15,18H,4-5,8-11H2,1H3,(H,26,32)(H,25,27,33) | PDB
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| n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373784
(CHEMBL402887)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C22H21F3N8O3/c23-22(24,25)12-32-11-13(15-3-7-27-30-15)10-16(19(32)34)28-20(35)31-8-4-14(5-9-31)33-17-2-1-6-26-18(17)29-21(33)36/h1-3,6-7,10-11,14H,4-5,8-9,12H2,(H,27,30)(H,28,35)(H,26,29,36) | PDB
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PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373790
(CHEMBL445069)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(F)c1F Show InChI InChI=1S/C24H22F2N6O3/c1-30-13-14(16-4-2-5-17(25)20(16)26)12-18(22(30)33)28-23(34)31-10-7-15(8-11-31)32-19-6-3-9-27-21(19)29-24(32)35/h2-6,9,12-13,15H,7-8,10-11H2,1H3,(H,28,34)(H,27,29,35) | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | 567 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373785
(CHEMBL255755)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccnc1 Show InChI InChI=1S/C24H22F3N7O3/c25-24(26,27)14-33-13-16(15-3-1-7-28-12-15)11-18(21(33)35)30-22(36)32-9-5-17(6-10-32)34-19-4-2-8-29-20(19)31-23(34)37/h1-4,7-8,11-13,17H,5-6,9-10,14H2,(H,30,36)(H,29,31,37) | PDB
UniProtKB/SwissProt
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| n/a | n/a | 651 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373773
(CHEMBL402844)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1 Show InChI InChI=1S/C26H28N6O4/c1-36-15-14-31-17-19(18-6-3-2-4-7-18)16-21(24(31)33)28-25(34)30-12-9-20(10-13-30)32-22-8-5-11-27-23(22)29-26(32)35/h2-8,11,16-17,20H,9-10,12-15H2,1H3,(H,28,34)(H,27,29,35) | PDB
UniProtKB/SwissProt
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| n/a | n/a | 665 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373794
(CHEMBL270175)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(O)c1 Show InChI InChI=1S/C24H24N6O4/c1-28-14-16(15-4-2-5-18(31)12-15)13-19(22(28)32)26-23(33)29-10-7-17(8-11-29)30-20-6-3-9-25-21(20)27-24(30)34/h2-6,9,12-14,17,31H,7-8,10-11H2,1H3,(H,26,33)(H,25,27,34) | PDB
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| n/a | n/a | 715 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373781
(CHEMBL257252)Show SMILES Fc1cccc(-c2cc(NC(=O)N3CCC(CC3)n3c4cccnc4[nH]c3=O)c(=O)n(CC(F)(F)F)c2)c1F Show InChI InChI=1S/C25H21F5N6O3/c26-17-4-1-3-16(20(17)27)14-11-18(22(37)35(12-14)13-25(28,29)30)32-23(38)34-9-6-15(7-10-34)36-19-5-2-8-31-21(19)33-24(36)39/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,32,38)(H,31,33,39) | PDB
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| n/a | n/a | 811 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373767
(CHEMBL270392)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1O Show InChI InChI=1S/C24H24N6O4/c1-28-14-15(17-5-2-3-7-20(17)31)13-18(22(28)32)26-23(33)29-11-8-16(9-12-29)30-19-6-4-10-25-21(19)27-24(30)34/h2-7,10,13-14,16,31H,8-9,11-12H2,1H3,(H,26,33)(H,25,27,34) | PDB
UniProtKB/SwissProt
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PC cid
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UniChem
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| Article
PubMed
| n/a | n/a | 827 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373778
(CHEMBL257902)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)C1C=CN=N1 |c:32,34| Show InChI InChI=1S/C21H22N8O3/c1-27-12-13(15-4-8-23-26-15)11-16(19(27)30)24-20(31)28-9-5-14(6-10-28)29-17-3-2-7-22-18(17)25-21(29)32/h2-4,7-8,11-12,14-15H,5-6,9-10H2,1H3,(H,24,31)(H,22,25,32) | PDB
UniProtKB/SwissProt
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| Article
PubMed
| n/a | n/a | 872 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373783
(CHEMBL255136)Show SMILES Oc1ccc(cc1)-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(CC(F)(F)F)c1 Show InChI InChI=1S/C25H23F3N6O4/c26-25(27,28)14-33-13-16(15-3-5-18(35)6-4-15)12-19(22(33)36)30-23(37)32-10-7-17(8-11-32)34-20-2-1-9-29-21(20)31-24(34)38/h1-6,9,12-13,17,35H,7-8,10-11,14H2,(H,30,37)(H,29,31,38) | PDB
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PubMed
| n/a | n/a | 971 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373777
(CHEMBL257094)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccc(F)c1F Show InChI InChI=1S/C26H26F2N6O4/c1-38-13-12-33-15-16(18-4-2-5-19(27)22(18)28)14-20(24(33)35)30-25(36)32-10-7-17(8-11-32)34-21-6-3-9-29-23(21)31-26(34)37/h2-6,9,14-15,17H,7-8,10-13H2,1H3,(H,30,36)(H,29,31,37) | PDB
UniProtKB/SwissProt
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PC cid
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UniChem
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| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373766
(CHEMBL403373)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccnc1 Show InChI InChI=1S/C23H23N7O3/c1-28-14-16(15-4-2-8-24-13-15)12-18(21(28)31)26-22(32)29-10-6-17(7-11-29)30-19-5-3-9-25-20(19)27-23(30)33/h2-5,8-9,12-14,17H,6-7,10-11H2,1H3,(H,26,32)(H,25,27,33) | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | 1.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373788
(CHEMBL255999)Show SMILES COCCn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1cccnc1 Show InChI InChI=1S/C25H27N7O4/c1-36-13-12-31-16-18(17-4-2-8-26-15-17)14-20(23(31)33)28-24(34)30-10-6-19(7-11-30)32-21-5-3-9-27-22(21)29-25(32)35/h2-5,8-9,14-16,19H,6-7,10-13H2,1H3,(H,28,34)(H,27,29,35) | PDB
UniProtKB/SwissProt
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UniChem
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| Article
PubMed
| n/a | n/a | 1.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373784
(CHEMBL402887)Show SMILES FC(F)(F)Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccn[nH]1 Show InChI InChI=1S/C22H21F3N8O3/c23-22(24,25)12-32-11-13(15-3-7-27-30-15)10-16(19(32)34)28-20(35)31-8-4-14(5-9-31)33-17-2-1-6-26-18(17)29-21(33)36/h1-3,6-7,10-11,14H,4-5,8-9,12H2,(H,27,30)(H,28,35)(H,26,29,36) | PDB
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UniChem
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| Article
PubMed
| n/a | n/a | 1.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373775
(CHEMBL256802)Show SMILES COc1ccc(cc1)-c1cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c(=O)n(C)c1 Show InChI InChI=1S/C25H26N6O4/c1-29-15-17(16-5-7-19(35-2)8-6-16)14-20(23(29)32)27-24(33)30-12-9-18(10-13-30)31-21-4-3-11-26-22(21)28-25(31)34/h3-8,11,14-15,18H,9-10,12-13H2,1-2H3,(H,27,33)(H,26,28,34) | PDB
UniProtKB/SwissProt
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PubMed
| n/a | n/a | 1.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation by cell based assay |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
Calcitonin gene-related peptide type 1 receptor
(Homo sapiens (Human)) | BDBM50373779
(CHEMBL258070)Show SMILES Cn1cc(cc(NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)c1=O)-c1ccccc1 Show InChI InChI=1S/C24H24N6O3/c1-28-15-17(16-6-3-2-4-7-16)14-19(22(28)31)26-23(32)29-12-9-18(10-13-29)30-20-8-5-11-25-21(20)27-24(30)33/h2-8,11,14-15,18H,9-10,12-13H2,1H3,(H,26,32)(H,25,27,33) | PDB
UniProtKB/SwissProt
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PC cid
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| Article
PubMed
| n/a | n/a | 1.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CL receptor /RAMP1 assessed as inhibition of cAMP accumulation in presence of 50% human serum by cell based ... |
Bioorg Med Chem Lett 18: 755-8 (2008)
Article DOI: 10.1016/j.bmcl.2007.11.042
BindingDB Entry DOI: 10.7270/Q2T43TZ2 |
More data for this
Ligand-Target Pair | |
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