Found 104 hits with Last Name = 'chase' and Initial = 'ps' 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 |
Collagenase 3
(Homo sapiens (Human)) | BDBM16596
(4-N,6-N-bis[(4-fluoro-3-methylphenyl)methyl]pyrimi...)Show SMILES Cc1cc(CNC(=O)c2cc(ncn2)C(=O)NCc2ccc(F)c(C)c2)ccc1F Show InChI InChI=1S/C22H20F2N4O2/c1-13-7-15(3-5-17(13)23)10-25-21(29)19-9-20(28-12-27-19)22(30)26-11-16-4-6-18(24)14(2)8-16/h3-9,12H,10-11H2,1-2H3,(H,25,29)(H,26,30) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| MMDB PDB Article PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247214
(5-(3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl)...)Show InChI InChI=1S/C14H10N4OS2/c1-8-10-7-11(12-15-16-14(20)19-12)21-13(10)18(17-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,16,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 900 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM29642
(4-[(5-thiophen-2-yl-2-thiophenyl)methylideneamino]...)Show InChI InChI=1S/C15H11NOS2/c17-12-5-3-11(4-6-12)16-10-13-7-8-15(19-13)14-2-1-9-18-14/h1-10,17H/b16-10+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247207
(2-(biphenyl-4-ylsulfonamido)pentanedioic acid | CH...)Show SMILES OC(=O)CCC(NS(=O)(=O)c1ccc(cc1)-c1ccccc1)C(O)=O Show InChI InChI=1S/C17H17NO6S/c19-16(20)11-10-15(17(21)22)18-25(23,24)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15,18H,10-11H2,(H,19,20)(H,21,22) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247209
(5-cyclohexyl-5-(2-(pyridin-4-yl)ethyl)pyrimidine-2...)Show InChI InChI=1S/C17H21N3O3/c21-14-17(13-4-2-1-3-5-13,15(22)20-16(23)19-14)9-6-12-7-10-18-11-8-12/h7-8,10-11,13H,1-6,9H2,(H2,19,20,21,22,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247466
(CHEMBL462629 | cid_5600879 | ethyl 2-cyano-2-(quin...)Show InChI InChI=1S/C13H11N3O2/c1-2-18-13(17)9(7-14)12-8-15-10-5-3-4-6-11(10)16-12/h3-6,8-9H,2H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247261
(5-(3,5-dimethoxyphenyl)-N-(4-fluorobenzo[d]thiazol...)Show SMILES COc1cc(OC)cc(c1)-c1nnc(Nc2nc3c(F)cccc3s2)o1 Show InChI InChI=1S/C17H13FN4O3S/c1-23-10-6-9(7-11(8-10)24-2)15-21-22-16(25-15)20-17-19-14-12(18)4-3-5-13(14)26-17/h3-8H,1-2H3,(H,19,20,22) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247465
(5-phenyl-5-(2-(pyridin-4-yl)ethyl)pyrimidine-2,4,6...)Show InChI InChI=1S/C17H15N3O3/c21-14-17(13-4-2-1-3-5-13,15(22)20-16(23)19-14)9-6-12-7-10-18-11-8-12/h1-5,7-8,10-11H,6,9H2,(H2,19,20,21,22,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247262
(3-(2-methoxy-6-(4-methoxyphenyl)pyridin-3-yl)-5-o-...)Show SMILES COc1ccc(cc1)-c1ccc(-c2noc(n2)-c2ccccc2C)c(OC)n1 Show InChI InChI=1S/C22H19N3O3/c1-14-6-4-5-7-17(14)22-24-20(25-28-22)18-12-13-19(23-21(18)27-3)15-8-10-16(26-2)11-9-15/h4-13H,1-3H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
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 |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM40478
(2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-1H-py...)Show InChI InChI=1S/C13H14N2O2S/c1-9-7-12(16)15-13(14-9)18-8-10-3-5-11(17-2)6-4-10/h3-7H,8H2,1-2H3,(H,14,15,16) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247461
(CHEMBL460516 | N-(2,3-dihydro-1H-inden-5-yl)-2-(5-...)Show InChI InChI=1S/C17H16N6O/c24-16(19-15-5-4-12-2-1-3-14(12)10-15)11-23-21-17(20-22-23)13-6-8-18-9-7-13/h4-10H,1-3,11H2,(H,19,24) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 4.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247490
(4-amino-3-(4-(hexyloxy)phenyl)-4-oxobutanoic acid ...)Show InChI InChI=1S/C16H23NO4/c1-2-3-4-5-10-21-13-8-6-12(7-9-13)14(16(17)20)11-15(18)19/h6-9,14H,2-5,10-11H2,1H3,(H2,17,20)(H,18,19) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 4.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50377983
(CHEMBL607299)Show SMILES [O-]N1C=C(c2ccc(Oc3ccccc3)cc2)[N+](=O)C2CCCCC12 |t:2| Show InChI InChI=1S/C20H20N2O3/c23-21-14-20(22(24)19-9-5-4-8-18(19)21)15-10-12-17(13-11-15)25-16-6-2-1-3-7-16/h1-3,6-7,10-14,18-19H,4-5,8-9H2 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank 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 |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247462
(CHEMBL516952 | N1,N3-bis(benzo[d][1,3]dioxol-5-ylm...)Show SMILES O=C(NCc1ccc2OCOc2c1)c1cccc(c1)C(=O)NCc1ccc2OCOc2c1 Show InChI InChI=1S/C24H20N2O6/c27-23(25-11-15-4-6-19-21(8-15)31-13-29-19)17-2-1-3-18(10-17)24(28)26-12-16-5-7-20-22(9-16)32-14-30-20/h1-10H,11-14H2,(H,25,27)(H,26,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 7.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247213
(3-ethyl-4-(1-(furan-2-ylmethyl)-2,6-dimethylpyridi...)Show SMILES [#6]-[#6]-[#7]1-[#6](=S)-[#16]-[#6](=O)\[#6]-1=[#6]-1\[#6]=[#6](-[#6])-[#7](-[#6]-c2ccco2)-[#6](-[#6])=[#6]-1 |c:23,t:11| Show InChI InChI=1S/C17H18N2O2S2/c1-4-18-15(16(20)23-17(18)22)13-8-11(2)19(12(3)9-13)10-14-6-5-7-21-14/h5-9H,4,10H2,1-3H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 8.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM40462
(5-[[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimid...)Show SMILES COC(=O)c1ccc(CSc2nc3scc(-c4cccs4)c3c(=O)[nH]2)o1 Show InChI InChI=1S/C17H12N2O4S3/c1-22-16(21)11-5-4-9(23-11)7-26-17-18-14(20)13-10(8-25-15(13)19-17)12-3-2-6-24-12/h2-6,8H,7H2,1H3,(H,18,19,20) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247210
(CHEMBL515767 | N-(benzo[d][1,3]dioxol-5-yl)-2-(5-(...)Show InChI InChI=1S/C16H12FN5O3/c17-12-4-2-1-3-11(12)16-19-21-22(20-16)8-15(23)18-10-5-6-13-14(7-10)25-9-24-13/h1-7H,8-9H2,(H,18,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 9.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247208
(2-oxo-2-phenylethyl 1-(methylsulfonyl)indoline-5-c...)Show SMILES CS(=O)(=O)N1CCc2cc(ccc12)C(=O)OCC(=O)c1ccccc1 Show InChI InChI=1S/C18H17NO5S/c1-25(22,23)19-10-9-14-11-15(7-8-16(14)19)18(21)24-12-17(20)13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 9.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM40467
(2-[(4-chlorobenzyl)thio]-1,5,6,7-tetrahydrocyclope...)Show InChI InChI=1S/C14H13ClN2OS/c15-10-6-4-9(5-7-10)8-19-14-16-12-3-1-2-11(12)13(18)17-14/h4-7H,1-3,8H2,(H,16,17,18) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50067040
(((E,E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-1,6-hept...)Show SMILES COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |w:12.11,5.4| Show InChI InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM40458
(3-[(2Z)-2-(3-allyl-4-keto-2-thioxo-thiazolidin-5-y...)Show SMILES OS(=O)(=O)CCCN1\C(Sc2ccccc12)=C1\SC(=S)N(CC=C)C1=O Show InChI InChI=1S/C16H16N2O4S4/c1-2-8-18-14(19)13(25-16(18)23)15-17(9-5-10-26(20,21)22)11-6-3-4-7-12(11)24-15/h2-4,6-7H,1,5,8-10H2,(H,20,21,22)/b15-13- | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM40464
(3-[(2Z)-2-(3-ethyl-4-keto-2-thioxo-thiazolidin-5-y...)Show SMILES CCN1C(=S)S\C(C1=O)=C1/Sc2ccccc2N1CCCS(O)(=O)=O Show InChI InChI=1S/C15H16N2O4S4/c1-2-16-13(18)12(24-15(16)22)14-17(8-5-9-25(19,20)21)10-6-3-4-7-11(10)23-14/h3-4,6-7H,2,5,8-9H2,1H3,(H,19,20,21)/b14-12- | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247260
(3-ethyl-5-(1-methylpyridin-2(1H)-ylidene)-2-thioxo...)Show InChI InChI=1S/C11H12N2OS2/c1-3-13-10(14)9(16-11(13)15)8-6-4-5-7-12(8)2/h4-7H,3H2,1-2H3/b9-8+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247460
(4-(methyl(4-phenylthiazol-2-yl)amino)phenol | CHEM...)Show InChI InChI=1S/C16H14N2OS/c1-18(13-7-9-14(19)10-8-13)16-17-15(11-20-16)12-5-3-2-4-6-12/h2-11,19H,1H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.33E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247212
(CHEMBL516029 | cid_2999799 | ethyl 1-(3-(1-cyano-2...)Show SMILES CCOC(=O)C(C#N)c1nc2ccccc2nc1N1CCCC(C1)C(=O)OCC Show InChI InChI=1S/C21H24N4O4/c1-3-28-20(26)14-8-7-11-25(13-14)19-18(15(12-22)21(27)29-4-2)23-16-9-5-6-10-17(16)24-19/h5-6,9-10,14-15H,3-4,7-8,11,13H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.33E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247211
(4-isobutyramido-N-(5-(methoxymethyl)-1,3,4-thiadia...)Show InChI InChI=1S/C15H18N4O3S/c1-9(2)13(20)16-11-6-4-10(5-7-11)14(21)17-15-19-18-12(23-15)8-22-3/h4-7,9H,8H2,1-3H3,(H,16,20)(H,17,19,21) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.53E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM40471
(2-[(5-keto-1,2-dihydro-1,2,4-triazol-3-yl)methylth...)Show SMILES O=C(CSCc1n[nH]c(=O)[nH]1)NCCOc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C19H20N4O4S/c24-18(13-28-12-17-21-19(25)23-22-17)20-9-10-26-15-7-4-8-16(11-15)27-14-5-2-1-3-6-14/h1-8,11H,9-10,12-13H2,(H,20,24)(H2,21,22,23,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.65E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247488
(6-(3-methylbenzyl)-3-(4-methylbenzyl)-3H-[1,2,3]tr...)Show InChI InChI=1S/C20H19N5O/c1-14-6-8-16(9-7-14)12-25-19-18(22-23-25)20(26)24(13-21-19)11-17-5-3-4-15(2)10-17/h3-10,13H,11-12H2,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 2.33E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247257
(CHEMBL474933 | cid_6398902 | triethylamine (E)-3-(...)Show SMILES CN1C(=S)S\C(C1=O)=C1/C=Cc2ccccc2N1CCCS(O)(=O)=O |c:10| Show InChI InChI=1S/C16H16N2O4S3/c1-17-15(19)14(24-16(17)23)13-8-7-11-5-2-3-6-12(11)18(13)9-4-10-25(20,21)22/h2-3,5-8H,4,9-10H2,1H3,(H,20,21,22)/b14-13+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.47E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247259
(6-acetyl-5-(2,4-dimethoxyphenyl)-7-methyl-2-((1,2,...)Show SMILES COc1ccc(C2C(C(C)=O)=C(C)N=c3sc(=Cc4cc(C)n(C)c4C)c(=O)n23)c(OC)c1 |w:17.17,t:10,13| Show InChI InChI=1S/C25H27N3O4S/c1-13-10-17(15(3)27(13)5)11-21-24(30)28-23(19-9-8-18(31-6)12-20(19)32-7)22(16(4)29)14(2)26-25(28)33-21/h8-12,23H,1-7H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50247464
(6-amino-1-(3-bromo-2-chloro-4-hydroxy-5-methoxyphe...)Show SMILES COc1cc(c(Cl)c(Br)c1O)-n1nc(C)c2C(C(C#N)C(=N)Oc12)c1ccccc1 Show InChI InChI=1S/C21H16BrClN4O3/c1-10-15-16(11-6-4-3-5-7-11)12(9-24)20(25)30-21(15)27(26-10)13-8-14(29-2)19(28)17(22)18(13)23/h3-8,12,16,25,28H,1-2H3 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Florida Atlantic University
Curated by ChEMBL
| Assay Description Inhibition of human recombinant MMP13 expressed in Escherichia coli |
Bioorg Med Chem 17: 990-1005 (2009)
Article DOI: 10.1016/j.bmc.2008.03.004 BindingDB Entry DOI: 10.7270/Q2GB24ZC |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50494305
(CHEMBL1979472)Show InChI InChI=1S/C20H29NO2/c22-20(19-14-13-18(23-19)15-11-12-15)21(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h13-17H,1-12H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 7.60E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50494306
(CHEMBL3088205)Show SMILES CCOc1ccc(cc1OCC)-c1cc(no1)C(=O)N(C1CCCCC1)C1CCCCC1 Show InChI InChI=1S/C26H36N2O4/c1-3-30-23-16-15-19(17-25(23)31-4-2)24-18-22(27-32-24)26(29)28(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h15-18,20-21H,3-14H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50494307
(CHEMBL1984536)Show SMILES COc1ccc(cc1)-c1cc(no1)C(=O)N(C1CCCCC1)C1CCCCC1 Show InChI InChI=1S/C23H30N2O3/c1-27-20-14-12-17(13-15-20)22-16-21(24-28-22)23(26)25(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h12-16,18-19H,2-11H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 859 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50494308
(CHEMBL1973788)Show InChI InChI=1S/C22H28N2O2/c25-22(20-16-21(26-23-20)17-10-4-1-5-11-17)24(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1,4-5,10-11,16,18-19H,2-3,6-9,12-15H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 662 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50494309
(CHEMBL3088203)Show InChI InChI=1S/C22H34N2O2/c25-22(20-16-21(26-23-20)17-10-4-1-5-11-17)24(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h16-19H,1-15H2 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50494310
(CHEMBL1968913)Show InChI InChI=1S/C19H30N2O2/c1-14(2)18-13-17(20-23-18)19(22)21(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h13-16H,3-12H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 2.23E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50494311
(CHEMBL3088202)Show InChI InChI=1S/C19H24N2O2/c1-2-9-17-14-18(20-23-17)19(22)21(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h3,5-6,10-11,14,16H,2,4,7-9,12-13H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM37340
(MLS000116372 | N,N-dicyclohexyl-5-propyl-1,2-oxazo...)Show InChI InChI=1S/C19H30N2O2/c1-2-9-17-14-18(20-23-17)19(22)21(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h14-16H,2-13H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 7.87E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P1 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50494312
(CHEMBL3087666)Show InChI InChI=1S/C20H18N2O2/c23-20(18-13-19(24-21-18)16-11-12-16)22(17-9-5-2-6-10-17)14-15-7-3-1-4-8-15/h1-10,13,16H,11-12,14H2 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells after 4 hrs by fluorescence assay |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50494313
(CHEMBL1976353)Show InChI InChI=1S/C19H28N2O2/c22-19(17-13-18(23-20-17)14-11-12-14)21(16-9-5-6-10-16)15-7-3-1-2-4-8-15/h13-16H,1-12H2 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 2.75E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells after 4 hrs by fluorescence assay |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50494314
(CHEMBL1965004)Show InChI InChI=1S/C21H32N2O2/c1-15-8-6-7-11-19(15)23(17-9-4-2-3-5-10-17)21(24)18-14-20(25-22-18)16-12-13-16/h14-17,19H,2-13H2,1H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 535 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells after 4 hrs by fluorescence assay |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50494315
(CHEMBL2004782)Show InChI InChI=1S/C20H30N2O2/c1-14-7-5-6-10-18(14)22(16-8-3-2-4-9-16)20(23)17-13-19(24-21-17)15-11-12-15/h13-16,18H,2-12H2,1H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 337 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells after 4 hrs by fluorescence assay |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50494316
(CHEMBL1975200)Show InChI InChI=1S/C20H30N2O2/c23-20(18-13-19(24-21-18)16-11-12-16)22(17-9-5-2-6-10-17)14-15-7-3-1-4-8-15/h13,15-17H,1-12,14H2 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 3.43E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells after 4 hrs by fluorescence assay |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50494317
(CHEMBL1972130)Show InChI InChI=1S/C18H26N2O2/c21-18(16-12-17(22-19-16)13-10-11-13)20(15-8-4-5-9-15)14-6-2-1-3-7-14/h12-15H,1-11H2 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 1.68E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells after 4 hrs by fluorescence assay |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50494309
(CHEMBL3088203)Show InChI InChI=1S/C22H34N2O2/c25-22(20-16-21(26-23-20)17-10-4-1-5-11-17)24(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h16-19H,1-15H2 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 559 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at human S1P3 receptor expressed in CHO cells after 4 hrs by fluorescence assay |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 5
(Homo sapiens (Human)) | BDBM50494318
(CHEMBL1970071)Show InChI InChI=1S/C19H28N2O2/c22-19(17-13-18(23-20-17)14-11-12-14)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h13-16H,1-12H2 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid PDB UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P5 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 4
(Homo sapiens (Human)) | BDBM50494314
(CHEMBL1965004)Show InChI InChI=1S/C21H32N2O2/c1-15-8-6-7-11-19(15)23(17-9-4-2-3-5-10-17)21(24)18-14-20(25-22-18)16-12-13-16/h14-17,19H,2-13H2,1H3 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P4 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 4
(Homo sapiens (Human)) | BDBM50494307
(CHEMBL1984536)Show SMILES COc1ccc(cc1)-c1cc(no1)C(=O)N(C1CCCCC1)C1CCCCC1 Show InChI InChI=1S/C23H30N2O3/c1-27-20-14-12-17(13-15-20)22-16-21(24-28-22)23(26)25(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h12-16,18-19H,2-11H2,1H3 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P4 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 4
(Homo sapiens (Human)) | BDBM50494318
(CHEMBL1970071)Show InChI InChI=1S/C19H28N2O2/c22-19(17-13-18(23-20-17)14-11-12-14)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h13-16H,1-12H2 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid PDB UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Agonist activity at S1P4 receptor (unknown origin) |
Bioorg Med Chem Lett 23: 6346-9 (2013)
Article DOI: 10.1016/j.bmcl.2013.09.075 BindingDB Entry DOI: 10.7270/Q2668H4K |
More data for this Ligand-Target Pair | |