Found 59 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 |
|---|
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50153534
(3-(2,6-Dichloro-phenyl)-5-(2-[1,3]dioxan-2-yl-ethy...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(CCC3OCCCO3)onc2-c2c(Cl)cccc2Cl)cc1 |(8.52,-1.48,;6.98,-1.48,;6.6,,;6.98,1.49,;8.52,1.49,;5.05,,;4.29,-1.34,;2.74,-1.36,;1.96,-.03,;.42,-.05,;-.67,-1.15,;-.27,-2.64,;-2.14,-.75,;-2.54,.72,;-1.59,1.95,;-2.68,3.03,;-2.3,4.53,;-.81,4.94,;-.41,6.43,;-1.49,7.5,;-2.98,7.12,;-3.38,5.62,;-4.08,.81,;-4.62,-.63,;-3.42,-1.59,;-3.33,-3.13,;-1.98,-3.83,;-.48,-4.23,;-1.87,-5.39,;-3.17,-6.21,;-4.55,-5.51,;-4.64,-3.99,;-6.01,-3.3,;2.71,1.31,;4.25,1.32,)| Show InChI InChI=1S/C26H29Cl2N3O4/c1-3-31(4-2)18-11-9-17(10-12-18)29-26(32)24-21(13-14-22-33-15-6-16-34-22)35-30-25(24)23-19(27)7-5-8-20(23)28/h5,7-12,22H,3-4,6,13-16H2,1-2H3,(H,29,32) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161052
(3-(2,6-Dichloro-phenyl)-5-(2-[1,3]dioxan-2-yl-ethy...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(CCC3OCCCO3)onc2-c2c(Cl)cccc2Cl)c(C)c1 |(8.47,1.42,;6.93,1.42,;6.53,-.05,;6.93,-1.55,;8.47,-1.55,;4.99,-.08,;4.25,-1.42,;2.68,-1.43,;1.91,-.12,;.37,-.12,;-.72,-1.22,;-.32,-2.71,;-2.19,-.82,;-2.59,.65,;-1.63,1.87,;-2.73,2.96,;-2.35,4.47,;-.86,4.85,;-.46,6.35,;-1.53,7.43,;-3.03,7.05,;-3.45,5.54,;-4.12,.74,;-4.67,-.7,;-3.47,-1.66,;-3.38,-3.2,;-2.02,-3.9,;-.53,-4.3,;-1.93,-5.46,;-3.22,-6.28,;-4.6,-5.6,;-4.68,-4.06,;-6.06,-3.37,;2.66,1.23,;1.89,2.57,;4.2,1.25,)| Show InChI InChI=1S/C27H31Cl2N3O4/c1-4-32(5-2)18-10-11-21(17(3)16-18)30-27(33)25-22(12-13-23-34-14-7-15-35-23)36-31-26(25)24-19(28)8-6-9-20(24)29/h6,8-11,16,23H,4-5,7,12-15H2,1-3H3,(H,30,33) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161052
(3-(2,6-Dichloro-phenyl)-5-(2-[1,3]dioxan-2-yl-ethy...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(CCC3OCCCO3)onc2-c2c(Cl)cccc2Cl)c(C)c1 |(8.47,1.42,;6.93,1.42,;6.53,-.05,;6.93,-1.55,;8.47,-1.55,;4.99,-.08,;4.25,-1.42,;2.68,-1.43,;1.91,-.12,;.37,-.12,;-.72,-1.22,;-.32,-2.71,;-2.19,-.82,;-2.59,.65,;-1.63,1.87,;-2.73,2.96,;-2.35,4.47,;-.86,4.85,;-.46,6.35,;-1.53,7.43,;-3.03,7.05,;-3.45,5.54,;-4.12,.74,;-4.67,-.7,;-3.47,-1.66,;-3.38,-3.2,;-2.02,-3.9,;-.53,-4.3,;-1.93,-5.46,;-3.22,-6.28,;-4.6,-5.6,;-4.68,-4.06,;-6.06,-3.37,;2.66,1.23,;1.89,2.57,;4.2,1.25,)| Show InChI InChI=1S/C27H31Cl2N3O4/c1-4-32(5-2)18-10-11-21(17(3)16-18)30-27(33)25-22(12-13-23-34-14-7-15-35-23)36-31-26(25)24-19(28)8-6-9-20(24)29/h6,8-11,16,23H,4-5,7,12-15H2,1-3H3,(H,30,33) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50153534
(3-(2,6-Dichloro-phenyl)-5-(2-[1,3]dioxan-2-yl-ethy...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(CCC3OCCCO3)onc2-c2c(Cl)cccc2Cl)cc1 |(8.52,-1.48,;6.98,-1.48,;6.6,,;6.98,1.49,;8.52,1.49,;5.05,,;4.29,-1.34,;2.74,-1.36,;1.96,-.03,;.42,-.05,;-.67,-1.15,;-.27,-2.64,;-2.14,-.75,;-2.54,.72,;-1.59,1.95,;-2.68,3.03,;-2.3,4.53,;-.81,4.94,;-.41,6.43,;-1.49,7.5,;-2.98,7.12,;-3.38,5.62,;-4.08,.81,;-4.62,-.63,;-3.42,-1.59,;-3.33,-3.13,;-1.98,-3.83,;-.48,-4.23,;-1.87,-5.39,;-3.17,-6.21,;-4.55,-5.51,;-4.64,-3.99,;-6.01,-3.3,;2.71,1.31,;4.25,1.32,)| Show InChI InChI=1S/C26H29Cl2N3O4/c1-3-31(4-2)18-11-9-17(10-12-18)29-26(32)24-21(13-14-22-33-15-6-16-34-22)35-30-25(24)23-19(27)7-5-8-20(23)28/h5,7-12,22H,3-4,6,13-16H2,1-2H3,(H,29,32) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161056
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(C)c1 |(7.74,-1.72,;6.25,-1.28,;5.92,.23,;7.04,1.27,;6.69,2.75,;4.43,.67,;4.02,2.16,;2.56,2.56,;1.49,1.47,;-.04,1.86,;-1.1,.77,;-.71,-.71,;-2.58,1.16,;-2.98,2.65,;-2.03,3.86,;-4.51,2.72,;-5.07,1.3,;-3.85,.32,;-3.78,-1.22,;-2.4,-1.92,;-.91,-2.31,;-2.32,-3.46,;-3.63,-4.3,;-5,-3.6,;-5.07,-2.06,;-6.43,-1.37,;1.89,,;.78,-1.1,;3.38,-.4,)| Show InChI InChI=1S/C22H23Cl2N3O2/c1-5-27(6-2)15-10-11-18(13(3)12-15)25-22(28)19-14(4)29-26-21(19)20-16(23)8-7-9-17(20)24/h7-12H,5-6H2,1-4H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161056
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(C)c1 |(7.74,-1.72,;6.25,-1.28,;5.92,.23,;7.04,1.27,;6.69,2.75,;4.43,.67,;4.02,2.16,;2.56,2.56,;1.49,1.47,;-.04,1.86,;-1.1,.77,;-.71,-.71,;-2.58,1.16,;-2.98,2.65,;-2.03,3.86,;-4.51,2.72,;-5.07,1.3,;-3.85,.32,;-3.78,-1.22,;-2.4,-1.92,;-.91,-2.31,;-2.32,-3.46,;-3.63,-4.3,;-5,-3.6,;-5.07,-2.06,;-6.43,-1.37,;1.89,,;.78,-1.1,;3.38,-.4,)| Show InChI InChI=1S/C22H23Cl2N3O2/c1-5-27(6-2)15-10-11-18(13(3)12-15)25-22(28)19-14(4)29-26-21(19)20-16(23)8-7-9-17(20)24/h7-12H,5-6H2,1-4H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161037
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(CC)c1 |(7.71,-1.64,;6.22,-1.2,;5.88,.3,;7,1.35,;6.64,2.84,;4.39,.75,;3.97,2.24,;2.53,2.63,;1.45,1.55,;-.07,1.95,;-1.13,.85,;-.75,-.63,;-2.61,1.24,;-3.02,2.73,;-2.07,3.94,;-4.55,2.8,;-5.1,1.38,;-3.88,.4,;-3.81,-1.14,;-2.44,-1.84,;-.95,-2.24,;-2.35,-3.38,;-3.67,-4.22,;-5.03,-3.52,;-5.1,-1.98,;-6.48,-1.29,;1.85,.09,;.75,-1.01,;1.15,-2.49,;3.34,-.31,)| Show InChI InChI=1S/C23H25Cl2N3O2/c1-5-15-13-16(28(6-2)7-3)11-12-19(15)26-23(29)20-14(4)30-27-22(20)21-17(24)9-8-10-18(21)25/h8-13H,5-7H2,1-4H3,(H,26,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161038
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1C |(7.65,-1.7,;6.16,-1.26,;5.81,.25,;6.93,1.3,;6.58,2.77,;4.32,.69,;3.92,2.18,;2.46,2.58,;1.38,1.49,;-.13,1.89,;-1.2,.79,;-.81,-.68,;-2.67,1.18,;-3.09,2.67,;-2.14,3.89,;-4.61,2.74,;-5.17,1.32,;-3.95,.34,;-3.89,-1.2,;-2.51,-1.9,;-1.02,-2.29,;-2.42,-3.43,;-3.72,-4.27,;-5.1,-3.57,;-5.17,-2.04,;-6.54,-1.34,;1.78,.02,;3.27,-.37,;3.67,-1.85,)| Show InChI InChI=1S/C22H23Cl2N3O2/c1-5-27(6-2)18-11-10-15(12-13(18)3)25-22(28)19-14(4)29-26-21(19)20-16(23)8-7-9-17(20)24/h7-12H,5-6H2,1-4H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >100 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50153535
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(7.8,-1.79,;6.33,-1.35,;5.95,.15,;7.07,1.22,;6.73,2.7,;4.47,.6,;3.4,-.45,;1.89,-.05,;1.51,1.42,;.02,1.81,;-1.09,.71,;-.67,-.78,;-2.57,1.11,;-2.95,2.6,;-2.02,3.81,;-4.5,2.67,;-5.04,1.23,;-3.84,.26,;-3.76,-1.28,;-2.39,-1.98,;-.84,-1.98,;-2.32,-3.53,;-3.58,-4.37,;-4.97,-3.67,;-5.06,-2.12,;-6.44,-1.45,;2.6,2.51,;4.05,2.12,)| Show InChI InChI=1S/C21H21Cl2N3O2/c1-4-26(5-2)15-11-9-14(10-12-15)24-21(27)18-13(3)28-25-20(18)19-16(22)7-6-8-17(19)23/h6-12H,4-5H2,1-3H3,(H,24,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50153535
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(7.8,-1.79,;6.33,-1.35,;5.95,.15,;7.07,1.22,;6.73,2.7,;4.47,.6,;3.4,-.45,;1.89,-.05,;1.51,1.42,;.02,1.81,;-1.09,.71,;-.67,-.78,;-2.57,1.11,;-2.95,2.6,;-2.02,3.81,;-4.5,2.67,;-5.04,1.23,;-3.84,.26,;-3.76,-1.28,;-2.39,-1.98,;-.84,-1.98,;-2.32,-3.53,;-3.58,-4.37,;-4.97,-3.67,;-5.06,-2.12,;-6.44,-1.45,;2.6,2.51,;4.05,2.12,)| Show InChI InChI=1S/C21H21Cl2N3O2/c1-4-26(5-2)15-11-9-14(10-12-15)24-21(27)18-13(3)28-25-20(18)19-16(22)7-6-8-17(19)23/h6-12H,4-5H2,1-3H3,(H,24,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161051
(3-(2-Chloro-phenyl)-5-methyl-isoxazole-4-carboxyli...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2Cl)cc1 Show InChI InChI=1S/C21H22ClN3O2/c1-4-25(5-2)16-12-10-15(11-13-16)23-21(26)19-14(3)27-24-20(19)17-8-6-7-9-18(17)22/h6-13H,4-5H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161044
(3-(2-Bromo-phenyl)-5-methyl-isoxazole-4-carboxylic...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2Br)cc1 Show InChI InChI=1S/C21H22BrN3O2/c1-4-25(5-2)16-12-10-15(11-13-16)23-21(26)19-14(3)27-24-20(19)17-8-6-7-9-18(17)22/h6-13H,4-5H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161044
(3-(2-Bromo-phenyl)-5-methyl-isoxazole-4-carboxylic...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2Br)cc1 Show InChI InChI=1S/C21H22BrN3O2/c1-4-25(5-2)16-12-10-15(11-13-16)23-21(26)19-14(3)27-24-20(19)17-8-6-7-9-18(17)22/h6-13H,4-5H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161058
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)NCc1ccc2OCOc2c1)-c1c(Cl)cccc1Cl |(-3.38,2.35,;-4.33,1.12,;-5.86,1.2,;-6.42,-.22,;-5.22,-1.19,;-3.93,-.36,;-2.46,-.75,;-2.07,-2.24,;-1.39,.34,;.1,-.03,;.89,-1.35,;2.45,-1.34,;3.2,,;2.41,1.32,;.87,1.3,;.85,2.84,;-.23,3.93,;1.93,3.93,;3.43,4.35,;4.52,3.25,;4.09,1.79,;5.2,.7,;6.7,1.12,;7.99,.27,;9.18,1.26,;8.62,2.7,;7.08,2.59,;5.99,3.68,;-5.13,-2.73,;-3.77,-3.43,;-2.28,-3.83,;-3.67,-4.99,;-4.96,-5.81,;-6.34,-5.1,;-6.42,-3.57,;-7.8,-2.9,)| Show InChI InChI=1S/C26H19Cl2N3O5/c1-14-22(24(31-36-14)23-17(27)6-4-7-18(23)28)26(33)30-19-8-3-2-5-16(19)25(32)29-12-15-9-10-20-21(11-15)35-13-34-20/h2-11H,12-13H2,1H3,(H,29,32)(H,30,33) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 350 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161037
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(CC)c1 |(7.71,-1.64,;6.22,-1.2,;5.88,.3,;7,1.35,;6.64,2.84,;4.39,.75,;3.97,2.24,;2.53,2.63,;1.45,1.55,;-.07,1.95,;-1.13,.85,;-.75,-.63,;-2.61,1.24,;-3.02,2.73,;-2.07,3.94,;-4.55,2.8,;-5.1,1.38,;-3.88,.4,;-3.81,-1.14,;-2.44,-1.84,;-.95,-2.24,;-2.35,-3.38,;-3.67,-4.22,;-5.03,-3.52,;-5.1,-1.98,;-6.48,-1.29,;1.85,.09,;.75,-1.01,;1.15,-2.49,;3.34,-.31,)| Show InChI InChI=1S/C23H25Cl2N3O2/c1-5-15-13-16(28(6-2)7-3)11-12-19(15)26-23(29)20-14(4)30-27-22(20)21-17(24)9-8-10-18(21)25/h8-13H,5-7H2,1-4H3,(H,26,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161060
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.78,1.14,;8.03,-.21,;6.49,-.21,;5.69,1.12,;6.46,2.47,;7.99,2.47,;4.15,1.11,;3.37,2.44,;1.83,2.43,;1.08,1.07,;-.41,1.46,;-1.52,.37,;-1.11,-1.12,;-2.99,.76,;-3.38,2.24,;-2.43,3.45,;-4.92,2.33,;-5.45,.89,;-4.27,-.08,;-4.18,-1.62,;-2.8,-2.32,;-1.33,-2.71,;-2.73,-3.87,;-4.01,-4.7,;-5.39,-4.01,;-5.48,-2.47,;-6.86,-1.77,;1.87,-.24,;3.41,-.23,)| Show InChI InChI=1S/C22H23Cl2N3O2/c1-4-13-27(5-2)16-11-9-15(10-12-16)25-22(28)19-14(3)29-26-21(19)20-17(23)7-6-8-18(20)24/h6-12H,4-5,13H2,1-3H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 410 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161060
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.78,1.14,;8.03,-.21,;6.49,-.21,;5.69,1.12,;6.46,2.47,;7.99,2.47,;4.15,1.11,;3.37,2.44,;1.83,2.43,;1.08,1.07,;-.41,1.46,;-1.52,.37,;-1.11,-1.12,;-2.99,.76,;-3.38,2.24,;-2.43,3.45,;-4.92,2.33,;-5.45,.89,;-4.27,-.08,;-4.18,-1.62,;-2.8,-2.32,;-1.33,-2.71,;-2.73,-3.87,;-4.01,-4.7,;-5.39,-4.01,;-5.48,-2.47,;-6.86,-1.77,;1.87,-.24,;3.41,-.23,)| Show InChI InChI=1S/C22H23Cl2N3O2/c1-4-13-27(5-2)16-11-9-15(10-12-16)25-22(28)19-14(3)29-26-21(19)20-17(23)7-6-8-18(20)24/h6-12H,4-5,13H2,1-3H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 510 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161042
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)N1CCCCCC1)-c1c(Cl)cccc1Cl |(-2.05,1.99,;-3,.78,;-4.53,.86,;-5.07,-.57,;-3.88,-1.52,;-2.6,-.68,;-1.14,-1.08,;-.74,-2.57,;-.05,,;1.44,-.38,;2.21,-1.68,;3.77,-1.68,;4.51,-.33,;3.72,.99,;2.19,.97,;2.19,2.5,;1.09,3.6,;3.26,3.6,;2.74,5.06,;3.56,6.36,;5.09,6.55,;6.19,5.46,;6.02,3.92,;4.72,3.09,;-3.79,-3.05,;-2.44,-3.75,;-.95,-4.16,;-2.35,-5.31,;-3.63,-6.14,;-5,-5.43,;-5.09,-3.91,;-6.47,-3.23,)| Show InChI InChI=1S/C24H23Cl2N3O3/c1-15-20(22(28-32-15)21-17(25)10-8-11-18(21)26)23(30)27-19-12-5-4-9-16(19)24(31)29-13-6-2-3-7-14-29/h4-5,8-12H,2-3,6-7,13-14H2,1H3,(H,27,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 510 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161064
(5-Methyl-3-(2-nitro-phenyl)-isoxazole-4-carboxylic...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(n[o+][c-]2C)-c2ccccc2[N+]([O-])=O)cc1 Show InChI InChI=1S/C21H22N4O4/c1-4-24(5-2)16-12-10-15(11-13-16)22-21(26)19-14(3)29-23-20(19)17-8-6-7-9-18(17)25(27)28/h6-13H,4-5H2,1-3H3,(H,22,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161062
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(OC)c1 |(7.72,-1.64,;6.22,-1.19,;5.88,.3,;7,1.34,;6.64,2.84,;4.39,.74,;3.97,2.23,;2.53,2.63,;1.45,1.55,;-.07,1.95,;-1.13,.86,;-.75,-.63,;-2.61,1.25,;-3.02,2.73,;-2.07,3.93,;-4.55,2.81,;-5.1,1.37,;-3.88,.41,;-3.81,-1.13,;-2.44,-1.83,;-.95,-2.22,;-2.35,-3.39,;-3.68,-4.2,;-5.03,-3.53,;-5.1,-1.99,;-6.48,-1.29,;1.85,.09,;.75,-1,;1.15,-2.49,;3.34,-.31,)| Show InChI InChI=1S/C22H23Cl2N3O3/c1-5-27(6-2)14-10-11-17(18(12-14)29-4)25-22(28)19-13(3)30-26-21(19)20-15(23)8-7-9-16(20)24/h7-12H,5-6H2,1-4H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161064
(5-Methyl-3-(2-nitro-phenyl)-isoxazole-4-carboxylic...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(n[o+][c-]2C)-c2ccccc2[N+]([O-])=O)cc1 Show InChI InChI=1S/C21H22N4O4/c1-4-24(5-2)16-12-10-15(11-13-16)22-21(26)19-14(3)29-23-20(19)17-8-6-7-9-18(17)25(27)28/h6-13H,4-5H2,1-3H3,(H,22,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 620 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161051
(3-(2-Chloro-phenyl)-5-methyl-isoxazole-4-carboxyli...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2Cl)cc1 Show InChI InChI=1S/C21H22ClN3O2/c1-4-25(5-2)16-12-10-15(11-13-16)23-21(26)19-14(3)27-24-20(19)17-8-6-7-9-18(17)22/h6-13H,4-5H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 690 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161042
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)N1CCCCCC1)-c1c(Cl)cccc1Cl |(-2.05,1.99,;-3,.78,;-4.53,.86,;-5.07,-.57,;-3.88,-1.52,;-2.6,-.68,;-1.14,-1.08,;-.74,-2.57,;-.05,,;1.44,-.38,;2.21,-1.68,;3.77,-1.68,;4.51,-.33,;3.72,.99,;2.19,.97,;2.19,2.5,;1.09,3.6,;3.26,3.6,;2.74,5.06,;3.56,6.36,;5.09,6.55,;6.19,5.46,;6.02,3.92,;4.72,3.09,;-3.79,-3.05,;-2.44,-3.75,;-.95,-4.16,;-2.35,-5.31,;-3.63,-6.14,;-5,-5.43,;-5.09,-3.91,;-6.47,-3.23,)| Show InChI InChI=1S/C24H23Cl2N3O3/c1-15-20(22(28-32-15)21-17(25)10-8-11-18(21)26)23(30)27-19-12-5-4-9-16(19)24(31)29-13-6-2-3-7-14-29/h4-5,8-12H,2-3,6-7,13-14H2,1H3,(H,27,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 860 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161055
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CN1CCc2ccccc2C1Cc1ccccc1NC(=O)c1c(C)onc1-c1c(Cl)cccc1Cl |(4.43,.53,;4.43,2.07,;5.76,2.83,;5.78,4.37,;4.43,5.16,;4.43,6.66,;3.13,7.43,;1.79,6.66,;1.78,5.16,;3.1,4.37,;3.12,2.83,;1.78,2.07,;1.79,.53,;3.34,.56,;4.13,-.78,;3.38,-2.12,;1.83,-2.12,;1.03,-.82,;-.46,-.43,;-1.53,-1.52,;-1.13,-3.01,;-3,-1.12,;-3.4,.34,;-2.46,1.56,;-4.93,.44,;-5.49,-1,;-4.29,-1.96,;-4.21,-3.5,;-2.83,-4.2,;-1.34,-4.59,;-2.75,-5.76,;-4.03,-6.58,;-5.41,-5.89,;-5.49,-4.36,;-6.87,-3.66,)| Show InChI InChI=1S/C28H25Cl2N3O2/c1-17-25(27(32-35-17)26-21(29)11-7-12-22(26)30)28(34)31-23-13-6-4-9-19(23)16-24-20-10-5-3-8-18(20)14-15-33(24)2/h3-13,24H,14-16H2,1-2H3,(H,31,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 980 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161036
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)NCc1ccccc1)-c1c(Cl)cccc1Cl |(-2.61,2.47,;-3.56,1.25,;-5.09,1.35,;-5.64,-.1,;-4.45,-1.06,;-3.17,-.22,;-1.68,-.61,;-1.3,-2.11,;-.6,.48,;.89,.09,;1.68,-1.22,;3.23,-1.22,;3.97,.13,;3.18,1.46,;1.64,1.44,;1.64,2.98,;.54,4.07,;2.71,4.07,;4.21,4.47,;5.3,3.4,;4.88,1.91,;5.98,.83,;7.47,1.25,;7.87,2.72,;6.77,3.82,;-4.35,-2.61,;-5.65,-3.46,;-7.02,-2.76,;-5.57,-4.98,;-4.19,-5.68,;-2.91,-4.86,;-2.99,-3.3,;-1.49,-3.69,)| Show InChI InChI=1S/C25H19Cl2N3O3/c1-15-21(23(30-33-15)22-18(26)11-7-12-19(22)27)25(32)29-20-13-6-5-10-17(20)24(31)28-14-16-8-3-2-4-9-16/h2-13H,14H2,1H3,(H,28,31)(H,29,32) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161063
(3-Biphenyl-2-yl-5-methyl-isoxazole-4-carboxylic ac...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2-c2ccccc2)cc1 Show InChI InChI=1S/C27H27N3O2/c1-4-30(5-2)22-17-15-21(16-18-22)28-27(31)25-19(3)32-29-26(25)24-14-10-9-13-23(24)20-11-7-6-8-12-20/h6-18H,4-5H2,1-3H3,(H,28,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161055
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CN1CCc2ccccc2C1Cc1ccccc1NC(=O)c1c(C)onc1-c1c(Cl)cccc1Cl |(4.43,.53,;4.43,2.07,;5.76,2.83,;5.78,4.37,;4.43,5.16,;4.43,6.66,;3.13,7.43,;1.79,6.66,;1.78,5.16,;3.1,4.37,;3.12,2.83,;1.78,2.07,;1.79,.53,;3.34,.56,;4.13,-.78,;3.38,-2.12,;1.83,-2.12,;1.03,-.82,;-.46,-.43,;-1.53,-1.52,;-1.13,-3.01,;-3,-1.12,;-3.4,.34,;-2.46,1.56,;-4.93,.44,;-5.49,-1,;-4.29,-1.96,;-4.21,-3.5,;-2.83,-4.2,;-1.34,-4.59,;-2.75,-5.76,;-4.03,-6.58,;-5.41,-5.89,;-5.49,-4.36,;-6.87,-3.66,)| Show InChI InChI=1S/C28H25Cl2N3O2/c1-17-25(27(32-35-17)26-21(29)11-7-12-22(26)30)28(34)31-23-13-6-4-9-19(23)16-24-20-10-5-3-8-18(20)14-15-33(24)2/h3-13,24H,14-16H2,1-2H3,(H,31,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161054
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)C(=O)c1ccccc1NC(=O)c1c(C)onc1-c1c(Cl)cccc1Cl |(6.28,5.08,;5.21,3.97,;3.67,3.97,;2.88,5.34,;3.97,6.42,;2.57,2.89,;1.48,3.97,;2.57,1.35,;4.14,1.35,;4.91,.04,;4.16,-1.31,;2.62,-1.31,;1.83,,;.33,.37,;-.76,-.71,;-.34,-2.2,;-2.23,-.33,;-2.63,1.16,;-1.67,2.38,;-4.17,1.24,;-4.71,-.17,;-3.52,-1.15,;-3.42,-2.69,;-2.05,-3.39,;-.58,-3.8,;-1.98,-4.95,;-3.26,-5.79,;-4.64,-5.09,;-4.73,-3.55,;-6.11,-2.87,)| Show InChI InChI=1S/C22H21Cl2N3O3/c1-4-27(5-2)22(29)14-9-6-7-12-17(14)25-21(28)18-13(3)30-26-20(18)19-15(23)10-8-11-16(19)24/h6-12H,4-5H2,1-3H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161043
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)N1CCCCC1)-c1c(Cl)cccc1Cl |(-1.88,2.19,;-2.83,.97,;-4.37,1.05,;-4.91,-.37,;-3.72,-1.35,;-2.44,-.52,;-.97,-.89,;-.55,-2.38,;.12,.19,;1.61,-.17,;2.41,-1.51,;3.94,-1.49,;4.69,-.16,;3.92,1.16,;2.36,1.16,;2.36,2.7,;1.27,3.8,;3.45,3.8,;4.95,3.39,;6.03,4.49,;5.64,5.98,;4.15,6.37,;3.05,5.3,;-3.63,-2.89,;-2.25,-3.59,;-.78,-3.98,;-2.18,-5.12,;-3.47,-5.96,;-4.84,-5.26,;-4.93,-3.73,;-6.3,-3.03,)| Show InChI InChI=1S/C23H21Cl2N3O3/c1-14-19(21(27-31-14)20-16(24)9-7-10-17(20)25)22(29)26-18-11-4-3-8-15(18)23(30)28-12-5-2-6-13-28/h3-4,7-11H,2,5-6,12-13H2,1H3,(H,26,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161043
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)N1CCCCC1)-c1c(Cl)cccc1Cl |(-1.88,2.19,;-2.83,.97,;-4.37,1.05,;-4.91,-.37,;-3.72,-1.35,;-2.44,-.52,;-.97,-.89,;-.55,-2.38,;.12,.19,;1.61,-.17,;2.41,-1.51,;3.94,-1.49,;4.69,-.16,;3.92,1.16,;2.36,1.16,;2.36,2.7,;1.27,3.8,;3.45,3.8,;4.95,3.39,;6.03,4.49,;5.64,5.98,;4.15,6.37,;3.05,5.3,;-3.63,-2.89,;-2.25,-3.59,;-.78,-3.98,;-2.18,-5.12,;-3.47,-5.96,;-4.84,-5.26,;-4.93,-3.73,;-6.3,-3.03,)| Show InChI InChI=1S/C23H21Cl2N3O3/c1-14-19(21(27-31-14)20-16(24)9-7-10-17(20)25)22(29)26-18-11-4-3-8-15(18)23(30)28-12-5-2-6-13-28/h3-4,7-11H,2,5-6,12-13H2,1H3,(H,26,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161054
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)C(=O)c1ccccc1NC(=O)c1c(C)onc1-c1c(Cl)cccc1Cl |(6.28,5.08,;5.21,3.97,;3.67,3.97,;2.88,5.34,;3.97,6.42,;2.57,2.89,;1.48,3.97,;2.57,1.35,;4.14,1.35,;4.91,.04,;4.16,-1.31,;2.62,-1.31,;1.83,,;.33,.37,;-.76,-.71,;-.34,-2.2,;-2.23,-.33,;-2.63,1.16,;-1.67,2.38,;-4.17,1.24,;-4.71,-.17,;-3.52,-1.15,;-3.42,-2.69,;-2.05,-3.39,;-.58,-3.8,;-1.98,-4.95,;-3.26,-5.79,;-4.64,-5.09,;-4.73,-3.55,;-6.11,-2.87,)| Show InChI InChI=1S/C22H21Cl2N3O3/c1-4-27(5-2)22(29)14-9-6-7-12-17(14)25-21(28)18-13(3)30-26-20(18)19-15(23)10-8-11-16(19)24/h6-12H,4-5H2,1-3H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161062
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(OC)c1 |(7.72,-1.64,;6.22,-1.19,;5.88,.3,;7,1.34,;6.64,2.84,;4.39,.74,;3.97,2.23,;2.53,2.63,;1.45,1.55,;-.07,1.95,;-1.13,.86,;-.75,-.63,;-2.61,1.25,;-3.02,2.73,;-2.07,3.93,;-4.55,2.81,;-5.1,1.37,;-3.88,.41,;-3.81,-1.13,;-2.44,-1.83,;-.95,-2.22,;-2.35,-3.39,;-3.68,-4.2,;-5.03,-3.53,;-5.1,-1.99,;-6.48,-1.29,;1.85,.09,;.75,-1,;1.15,-2.49,;3.34,-.31,)| Show InChI InChI=1S/C22H23Cl2N3O3/c1-5-27(6-2)14-10-11-17(18(12-14)29-4)25-22(28)19-13(3)30-26-21(19)20-15(23)8-7-9-16(20)24/h7-12H,5-6H2,1-4H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161035
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CCO)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(7.99,2.47,;6.46,2.47,;5.7,1.12,;6.49,-.21,;8.03,-.21,;8.78,1.16,;4.16,1.12,;3.37,2.44,;1.83,2.43,;1.07,1.07,;-.42,1.46,;-1.51,.37,;-1.11,-1.12,;-2.98,.77,;-3.38,2.24,;-2.43,3.45,;-4.92,2.33,;-5.46,.89,;-4.26,-.08,;-4.18,-1.62,;-2.82,-2.32,;-1.32,-2.71,;-2.72,-3.87,;-4.01,-4.7,;-5.39,-4.01,;-5.48,-2.47,;-6.85,-1.77,;1.85,-.24,;3.41,-.23,)| Show InChI InChI=1S/C21H21Cl2N3O3/c1-3-26(11-12-27)15-9-7-14(8-10-15)24-21(28)18-13(2)29-25-20(18)19-16(22)5-4-6-17(19)23/h4-10,27H,3,11-12H2,1-2H3,(H,24,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161046
(3-(2-Methoxy-phenyl)-5-methyl-isoxazole-4-carboxyl...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2OC)cc1 Show InChI InChI=1S/C22H25N3O3/c1-5-25(6-2)17-13-11-16(12-14-17)23-22(26)20-15(3)28-24-21(20)18-9-7-8-10-19(18)27-4/h7-14H,5-6H2,1-4H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161061
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(c1)C(F)(F)F |(8.2,-.12,;6.64,-.03,;5.99,1.37,;6.83,2.63,;6.18,4,;4.44,1.46,;3.71,2.84,;2.2,2.89,;1.38,1.6,;-.16,1.65,;-1.21,.56,;-1.25,-.86,;-2.7,.95,;-3.1,2.44,;-2.14,3.65,;-4.63,2.51,;-5.19,1.09,;-3.96,.11,;-3.89,-1.43,;-5.19,-2.27,;-6.55,-1.58,;-5.12,-3.81,;-3.73,-4.51,;-2.42,-3.67,;-2.52,-2.13,;-1.03,-2.53,;2.11,.26,;3.64,.2,;1.29,-1.03,;-.32,-1.24,;1.79,-2.57,;.54,-2.24,)| Show InChI InChI=1S/C22H20Cl2F3N3O2/c1-4-30(5-2)13-9-10-17(14(11-13)22(25,26)27)28-21(31)18-12(3)32-29-20(18)19-15(23)7-6-8-16(19)24/h6-11H,4-5H2,1-3H3,(H,28,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161040
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(c1)C#N |(6.64,2.87,;6.98,1.37,;5.86,.32,;6.21,-1.18,;7.71,-1.62,;4.37,.76,;3.97,2.26,;2.5,2.66,;1.41,1.58,;-.09,1.98,;-1.17,.88,;-.77,-.62,;-2.64,1.28,;-3.05,2.75,;-2.09,3.96,;-4.58,2.84,;-5.13,1.39,;-3.92,.42,;-3.85,-1.12,;-2.48,-1.82,;-.98,-2.2,;-2.38,-3.37,;-3.68,-4.19,;-5.06,-3.51,;-5.14,-1.97,;-6.52,-1.27,;1.82,.11,;3.32,-.29,;1.53,-1.19,;1.12,-2.88,)| Show InChI InChI=1S/C22H20Cl2N4O2/c1-4-28(5-2)15-9-10-18(14(11-15)12-25)26-22(29)19-13(3)30-27-21(19)20-16(23)7-6-8-17(20)24/h6-11H,4-5H2,1-3H3,(H,26,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161039
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(C)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.61,2.51,;7.07,2.5,;6.32,1.16,;7.1,-.17,;4.78,1.13,;4,2.46,;2.46,2.46,;1.69,1.11,;.19,1.49,;-.89,.41,;-.48,-1.08,;-2.36,.79,;-2.77,2.28,;-1.81,3.49,;-4.29,2.36,;-4.84,.92,;-3.64,-.05,;-3.56,-1.59,;-2.18,-2.29,;-.7,-2.68,;-2.09,-3.83,;-3.4,-4.66,;-4.77,-3.97,;-4.85,-2.43,;-6.23,-1.73,;2.48,-.22,;4.02,-.19,)| Show InChI InChI=1S/C20H19Cl2N3O2/c1-4-25(3)14-10-8-13(9-11-14)23-20(26)17-12(2)27-24-19(17)18-15(21)6-5-7-16(18)22/h5-11H,4H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161058
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)NCc1ccc2OCOc2c1)-c1c(Cl)cccc1Cl |(-3.38,2.35,;-4.33,1.12,;-5.86,1.2,;-6.42,-.22,;-5.22,-1.19,;-3.93,-.36,;-2.46,-.75,;-2.07,-2.24,;-1.39,.34,;.1,-.03,;.89,-1.35,;2.45,-1.34,;3.2,,;2.41,1.32,;.87,1.3,;.85,2.84,;-.23,3.93,;1.93,3.93,;3.43,4.35,;4.52,3.25,;4.09,1.79,;5.2,.7,;6.7,1.12,;7.99,.27,;9.18,1.26,;8.62,2.7,;7.08,2.59,;5.99,3.68,;-5.13,-2.73,;-3.77,-3.43,;-2.28,-3.83,;-3.67,-4.99,;-4.96,-5.81,;-6.34,-5.1,;-6.42,-3.57,;-7.8,-2.9,)| Show InChI InChI=1S/C26H19Cl2N3O5/c1-14-22(24(31-36-14)23-17(27)6-4-7-18(23)28)26(33)30-19-8-3-2-5-16(19)25(32)29-12-15-9-10-20-21(11-15)35-13-34-20/h2-11H,12-13H2,1H3,(H,29,32)(H,30,33) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161039
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(C)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.61,2.51,;7.07,2.5,;6.32,1.16,;7.1,-.17,;4.78,1.13,;4,2.46,;2.46,2.46,;1.69,1.11,;.19,1.49,;-.89,.41,;-.48,-1.08,;-2.36,.79,;-2.77,2.28,;-1.81,3.49,;-4.29,2.36,;-4.84,.92,;-3.64,-.05,;-3.56,-1.59,;-2.18,-2.29,;-.7,-2.68,;-2.09,-3.83,;-3.4,-4.66,;-4.77,-3.97,;-4.85,-2.43,;-6.23,-1.73,;2.48,-.22,;4.02,-.19,)| Show InChI InChI=1S/C20H19Cl2N3O2/c1-4-25(3)14-10-8-13(9-11-14)23-20(26)17-12(2)27-24-19(17)18-15(21)6-5-7-16(18)22/h5-11H,4H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161034
(3-(4-Chloro-phenyl)-5-methyl-isoxazole-4-carboxyli...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C21H22ClN3O2/c1-4-25(5-2)18-12-10-17(11-13-18)23-21(26)19-14(3)27-24-20(19)15-6-8-16(22)9-7-15/h6-13H,4-5H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161063
(3-Biphenyl-2-yl-5-methyl-isoxazole-4-carboxylic ac...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2-c2ccccc2)cc1 Show InChI InChI=1S/C27H27N3O2/c1-4-30(5-2)22-17-15-21(16-18-22)28-27(31)25-19(3)32-29-26(25)24-14-10-9-13-23(24)20-11-7-6-8-12-20/h6-18H,4-5H2,1-3H3,(H,28,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161046
(3-(2-Methoxy-phenyl)-5-methyl-isoxazole-4-carboxyl...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccccc2OC)cc1 Show InChI InChI=1S/C22H25N3O3/c1-5-25(6-2)17-13-11-16(12-14-17)23-22(26)20-15(3)28-24-21(20)18-9-7-8-10-19(18)27-4/h7-14H,5-6H2,1-4H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161034
(3-(4-Chloro-phenyl)-5-methyl-isoxazole-4-carboxyli...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C21H22ClN3O2/c1-4-25(5-2)18-12-10-17(11-13-18)23-21(26)19-14(3)27-24-20(19)15-6-8-16(22)9-7-15/h6-13H,4-5H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161053
(3-(2,6-Dichloro-phenyl)-5-(2-[1,3]dioxan-2-yl-ethy...)Show SMILES Clc1cccc(Cl)c1-c1noc(CCC2OCCCO2)c1C(=O)Nc1ccccc1C(=O)N1CCCCC1 |(-6.93,-.52,;-6.13,-1.85,;-6.88,-3.2,;-6.08,-4.51,;-4.55,-4.49,;-3.8,-3.13,;-2.74,-4.25,;-4.59,-1.8,;-3.85,-.47,;-4.34,1,;-3.13,1.93,;-1.87,1.04,;-.42,1.56,;-.79,3.08,;.35,4.14,;1.82,3.68,;2.95,4.74,;2.61,6.23,;1.14,6.69,;,5.64,;-2.31,-.43,;-1.28,-1.54,;-1.73,-3.02,;.23,-1.19,;1.29,-2.31,;1.26,-3.83,;2.57,-4.65,;3.93,-3.9,;3.97,-2.36,;2.64,-1.56,;2.68,-.01,;1.38,.79,;4.04,.72,;5.35,-.1,;6.69,.63,;6.76,2.16,;5.46,2.99,;4.09,2.25,)| Show InChI InChI=1S/C28H29Cl2N3O5/c29-19-9-6-10-20(30)24(19)26-25(22(38-32-26)12-13-23-36-16-7-17-37-23)27(34)31-21-11-3-2-8-18(21)28(35)33-14-4-1-5-15-33/h2-3,6,8-11,23H,1,4-5,7,12-17H2,(H,31,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161053
(3-(2,6-Dichloro-phenyl)-5-(2-[1,3]dioxan-2-yl-ethy...)Show SMILES Clc1cccc(Cl)c1-c1noc(CCC2OCCCO2)c1C(=O)Nc1ccccc1C(=O)N1CCCCC1 |(-6.93,-.52,;-6.13,-1.85,;-6.88,-3.2,;-6.08,-4.51,;-4.55,-4.49,;-3.8,-3.13,;-2.74,-4.25,;-4.59,-1.8,;-3.85,-.47,;-4.34,1,;-3.13,1.93,;-1.87,1.04,;-.42,1.56,;-.79,3.08,;.35,4.14,;1.82,3.68,;2.95,4.74,;2.61,6.23,;1.14,6.69,;,5.64,;-2.31,-.43,;-1.28,-1.54,;-1.73,-3.02,;.23,-1.19,;1.29,-2.31,;1.26,-3.83,;2.57,-4.65,;3.93,-3.9,;3.97,-2.36,;2.64,-1.56,;2.68,-.01,;1.38,.79,;4.04,.72,;5.35,-.1,;6.69,.63,;6.76,2.16,;5.46,2.99,;4.09,2.25,)| Show InChI InChI=1S/C28H29Cl2N3O5/c29-19-9-6-10-20(30)24(19)26-25(22(38-32-26)12-13-23-36-16-7-17-37-23)27(34)31-21-11-3-2-8-18(21)28(35)33-14-4-1-5-15-33/h2-3,6,8-11,23H,1,4-5,7,12-17H2,(H,31,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161047
(5-Methyl-3-phenyl-isoxazole-4-carboxylic acid (4-d...)Show InChI InChI=1S/C21H23N3O2/c1-4-24(5-2)18-13-11-17(12-14-18)22-21(25)19-15(3)26-23-20(19)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3,(H,22,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161047
(5-Methyl-3-phenyl-isoxazole-4-carboxylic acid (4-d...)Show InChI InChI=1S/C21H23N3O2/c1-4-24(5-2)18-13-11-17(12-14-18)22-21(25)19-15(3)26-23-20(19)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3,(H,22,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161040
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(c1)C#N |(6.64,2.87,;6.98,1.37,;5.86,.32,;6.21,-1.18,;7.71,-1.62,;4.37,.76,;3.97,2.26,;2.5,2.66,;1.41,1.58,;-.09,1.98,;-1.17,.88,;-.77,-.62,;-2.64,1.28,;-3.05,2.75,;-2.09,3.96,;-4.58,2.84,;-5.13,1.39,;-3.92,.42,;-3.85,-1.12,;-2.48,-1.82,;-.98,-2.2,;-2.38,-3.37,;-3.68,-4.19,;-5.06,-3.51,;-5.14,-1.97,;-6.52,-1.27,;1.82,.11,;3.32,-.29,;1.53,-1.19,;1.12,-2.88,)| Show InChI InChI=1S/C22H20Cl2N4O2/c1-4-28(5-2)15-9-10-18(14(11-15)12-25)26-22(29)19-13(3)30-27-21(19)20-16(23)7-6-8-17(20)24/h6-11H,4-5H2,1-3H3,(H,26,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161035
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CCO)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(7.99,2.47,;6.46,2.47,;5.7,1.12,;6.49,-.21,;8.03,-.21,;8.78,1.16,;4.16,1.12,;3.37,2.44,;1.83,2.43,;1.07,1.07,;-.42,1.46,;-1.51,.37,;-1.11,-1.12,;-2.98,.77,;-3.38,2.24,;-2.43,3.45,;-4.92,2.33,;-5.46,.89,;-4.26,-.08,;-4.18,-1.62,;-2.82,-2.32,;-1.32,-2.71,;-2.72,-3.87,;-4.01,-4.7,;-5.39,-4.01,;-5.48,-2.47,;-6.85,-1.77,;1.85,-.24,;3.41,-.23,)| Show InChI InChI=1S/C21H21Cl2N3O3/c1-3-26(11-12-27)15-9-7-14(8-10-15)24-21(28)18-13(2)29-25-20(18)19-16(22)5-4-6-17(19)23/h4-10,27H,3,11-12H2,1-2H3,(H,24,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161050
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccc(cc1)N1CCCCC1)-c1c(Cl)cccc1Cl |(-2.43,3.45,;-3.38,2.24,;-4.92,2.33,;-5.45,.89,;-4.27,-.08,;-2.99,.77,;-1.52,.37,;-1.11,-1.12,;-.41,1.46,;1.08,1.07,;1.83,2.43,;3.37,2.44,;4.15,1.11,;3.41,-.23,;1.87,-.24,;5.69,1.12,;6.46,2.47,;7.99,2.47,;8.77,1.16,;8.03,-.21,;6.49,-.21,;-4.18,-1.62,;-5.48,-2.47,;-6.86,-1.77,;-5.39,-4.01,;-4.01,-4.7,;-2.73,-3.87,;-2.8,-2.32,;-1.33,-2.71,)| Show InChI InChI=1S/C22H21Cl2N3O2/c1-14-19(21(26-29-14)20-17(23)6-5-7-18(20)24)22(28)25-15-8-10-16(11-9-15)27-12-3-2-4-13-27/h5-11H,2-4,12-13H2,1H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161057
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1Cl |(7.64,-1.7,;6.16,-1.26,;5.8,.25,;6.92,1.3,;6.58,2.77,;4.32,.69,;3.92,2.18,;2.45,2.58,;1.37,1.49,;-.12,1.89,;-1.21,.79,;-.81,-.68,;-2.68,1.18,;-3.08,2.67,;-2.12,3.88,;-4.61,2.74,;-5.15,1.32,;-3.96,.34,;-3.87,-1.2,;-5.17,-2.03,;-6.55,-1.34,;-5.08,-3.57,;-3.7,-4.27,;-2.42,-3.43,;-2.51,-1.89,;-1.03,-2.29,;1.77,.02,;3.26,-.37,;3.67,-1.85,)| Show InChI InChI=1S/C21H20Cl3N3O2/c1-4-27(5-2)17-10-9-13(11-16(17)24)25-21(28)18-12(3)29-26-20(18)19-14(22)7-6-8-15(19)23/h6-11H,4-5H2,1-3H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161059
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(C(C)=O)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.1,2.57,;6.56,2.56,;5.81,1.21,;6.59,-.12,;8.13,-.12,;5.81,-1.45,;4.27,1.21,;3.46,2.54,;1.94,2.51,;1.17,1.16,;-.32,1.56,;-1.4,.46,;-1.02,-1.03,;-2.89,.86,;-3.28,2.33,;-2.33,3.55,;-4.82,2.42,;-5.36,.97,;-4.15,.02,;-4.08,-1.52,;-2.71,-2.22,;-1.21,-2.62,;-2.61,-3.78,;-3.91,-4.6,;-5.29,-3.92,;-5.38,-2.39,;-6.74,-1.69,;1.96,-.15,;3.51,-.15,)| Show InChI InChI=1S/C21H19Cl2N3O3/c1-4-26(13(3)27)15-10-8-14(9-11-15)24-21(28)18-12(2)29-25-20(18)19-16(22)6-5-7-17(19)23/h5-11H,4H2,1-3H3,(H,24,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161049
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCNc1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.88,2.51,;7.34,2.49,;6.6,1.16,;5.04,1.13,;4.27,2.46,;2.71,2.44,;1.97,1.11,;.47,1.49,;-.61,.39,;-.21,-1.08,;-2.09,.78,;-2.49,2.28,;-1.53,3.49,;-4.02,2.35,;-4.56,.92,;-3.36,-.05,;-3.29,-1.59,;-4.58,-2.43,;-5.96,-1.75,;-4.5,-3.97,;-3.12,-4.67,;-1.83,-3.83,;-1.9,-2.29,;-.42,-2.69,;2.76,-.22,;4.29,-.19,)| Show InChI InChI=1S/C19H17Cl2N3O2/c1-3-22-12-7-9-13(10-8-12)23-19(25)16-11(2)26-24-18(16)17-14(20)5-4-6-15(17)21/h4-10,22H,3H2,1-2H3,(H,23,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161038
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1C |(7.65,-1.7,;6.16,-1.26,;5.81,.25,;6.93,1.3,;6.58,2.77,;4.32,.69,;3.92,2.18,;2.46,2.58,;1.38,1.49,;-.13,1.89,;-1.2,.79,;-.81,-.68,;-2.67,1.18,;-3.09,2.67,;-2.14,3.89,;-4.61,2.74,;-5.17,1.32,;-3.95,.34,;-3.89,-1.2,;-2.51,-1.9,;-1.02,-2.29,;-2.42,-3.43,;-3.72,-4.27,;-5.1,-3.57,;-5.17,-2.04,;-6.54,-1.34,;1.78,.02,;3.27,-.37,;3.67,-1.85,)| Show InChI InChI=1S/C22H23Cl2N3O2/c1-5-27(6-2)18-11-10-15(12-13(18)3)25-22(28)19-14(4)29-26-21(19)20-16(23)8-7-9-17(20)24/h7-12H,5-6H2,1-4H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161041
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)Cc1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.87,3.4,;8.12,2.05,;6.58,2.05,;5.48,3.15,;5.88,4.64,;5.81,.72,;4.28,.72,;3.48,2.03,;1.94,2.02,;1.19,.68,;-.3,1.05,;-1.39,-.03,;-.99,-1.52,;-2.86,.35,;-3.26,1.83,;-2.31,3.05,;-4.8,1.91,;-5.34,.49,;-4.14,-.47,;-4.06,-2.03,;-5.36,-2.87,;-6.73,-2.18,;-5.27,-4.42,;-3.89,-5.11,;-2.6,-4.28,;-2.7,-2.71,;-1.2,-3.12,;1.97,-.65,;3.52,-.63,)| Show InChI InChI=1S/C22H23Cl2N3O2/c1-4-27(5-2)13-15-9-11-16(12-10-15)25-22(28)19-14(3)29-26-21(19)20-17(23)7-6-8-18(20)24/h6-12H,4-5,13H2,1-3H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161048
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCC(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)cc1 |(8.33,-.16,;6.79,-.16,;6,1.17,;6.77,2.49,;8.31,2.52,;4.46,1.14,;3.69,2.47,;2.13,2.46,;1.38,1.12,;-.11,1.51,;-1.2,.41,;-.78,-1.07,;-2.67,.79,;-3.07,2.28,;-2.11,3.5,;-4.61,2.35,;-5.14,.93,;-3.95,-.05,;-3.86,-1.58,;-5.17,-2.42,;-6.54,-1.73,;-5.07,-3.96,;-3.7,-4.66,;-2.42,-3.82,;-2.49,-2.28,;-1.02,-2.68,;2.17,-.21,;3.71,-.17,)| Show InChI InChI=1S/C22H22Cl2N2O2/c1-4-14(5-2)15-9-11-16(12-10-15)25-22(27)19-13(3)28-26-21(19)20-17(23)7-6-8-18(20)24/h6-12,14H,4-5H2,1-3H3,(H,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161061
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2c(Cl)cccc2Cl)c(c1)C(F)(F)F |(8.2,-.12,;6.64,-.03,;5.99,1.37,;6.83,2.63,;6.18,4,;4.44,1.46,;3.71,2.84,;2.2,2.89,;1.38,1.6,;-.16,1.65,;-1.21,.56,;-1.25,-.86,;-2.7,.95,;-3.1,2.44,;-2.14,3.65,;-4.63,2.51,;-5.19,1.09,;-3.96,.11,;-3.89,-1.43,;-5.19,-2.27,;-6.55,-1.58,;-5.12,-3.81,;-3.73,-4.51,;-2.42,-3.67,;-2.52,-2.13,;-1.03,-2.53,;2.11,.26,;3.64,.2,;1.29,-1.03,;-.32,-1.24,;1.79,-2.57,;.54,-2.24,)| Show InChI InChI=1S/C22H20Cl2F3N3O2/c1-4-30(5-2)13-9-10-17(14(11-13)22(25,26)27)28-21(31)18-12(3)32-29-20(18)19-15(23)7-6-8-16(19)24/h6-11H,4-5H2,1-3H3,(H,28,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161036
(3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carbo...)Show SMILES Cc1onc(c1C(=O)Nc1ccccc1C(=O)NCc1ccccc1)-c1c(Cl)cccc1Cl |(-2.61,2.47,;-3.56,1.25,;-5.09,1.35,;-5.64,-.1,;-4.45,-1.06,;-3.17,-.22,;-1.68,-.61,;-1.3,-2.11,;-.6,.48,;.89,.09,;1.68,-1.22,;3.23,-1.22,;3.97,.13,;3.18,1.46,;1.64,1.44,;1.64,2.98,;.54,4.07,;2.71,4.07,;4.21,4.47,;5.3,3.4,;4.88,1.91,;5.98,.83,;7.47,1.25,;7.87,2.72,;6.77,3.82,;-4.35,-2.61,;-5.65,-3.46,;-7.02,-2.76,;-5.57,-4.98,;-4.19,-5.68,;-2.91,-4.86,;-2.99,-3.3,;-1.49,-3.69,)| Show InChI InChI=1S/C25H19Cl2N3O3/c1-15-21(23(30-33-15)22-18(26)11-7-12-19(22)27)25(32)29-20-13-6-5-10-17(20)24(31)28-14-16-8-3-2-4-9-16/h2-13H,14H2,1H3,(H,28,31)(H,29,32) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.05E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of ghrelin-induced increase of intracellular [Ca2+] in CHO¿K cell FLIPR assay |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50161045
(3-(3-Chloro-phenyl)-5-methyl-isoxazole-4-carboxyli...)Show SMILES CCN(CC)c1ccc(NC(=O)c2c(C)onc2-c2cccc(Cl)c2)cc1 Show InChI InChI=1S/C21H22ClN3O2/c1-4-25(5-2)18-11-9-17(10-12-18)23-21(26)19-14(3)27-24-20(19)15-7-6-8-16(22)13-15/h6-13H,4-5H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.85E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of binding to human growth hormone secretagogue receptor |
Bioorg Med Chem Lett 15: 1201-4 (2005)
Article DOI: 10.1016/j.bmcl.2004.11.075
BindingDB Entry DOI: 10.7270/Q24Q7THD |
More data for this
Ligand-Target Pair | |
Search and Browse
