Found 31 hits Enz. Inhib. hit(s) with all data for entry = 50032142 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 |
|---|
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324826
((2S)-2-(2,6-dichloro-4-(3-hydroxy-3-(3-hydroxyphen...)Show SMILES OC(CCc1cc(Cl)c(C(=O)N[C@@H](CNC(=O)c2cccs2)C(O)=O)c(Cl)c1)c1cccc(O)c1 |r| Show InChI InChI=1S/C24H22Cl2N2O6S/c25-16-9-13(6-7-19(30)14-3-1-4-15(29)11-14)10-17(26)21(16)23(32)28-18(24(33)34)12-27-22(31)20-5-2-8-35-20/h1-5,8-11,18-19,29-30H,6-7,12H2,(H,27,31)(H,28,32)(H,33,34)/t18-,19?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1 by ELISA |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324824
((S)-2-(2-(benzofuran-2-carbonyl)-5,7-dichloro-1,2,...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1cc2ccccc2o1 |r| Show InChI InChI=1S/C27H21Cl2N3O6S/c28-17-10-15-13-32(26(35)20-11-14-4-1-2-5-19(14)38-20)8-7-16(15)23(29)22(17)25(34)31-18(27(36)37)12-30-24(33)21-6-3-9-39-21/h1-6,9-11,18H,7-8,12-13H2,(H,30,33)(H,31,34)(H,36,37)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324822
((S)-2-(2-(benzofuran-6-carbonyl)-5,7-dichloro-1,2,...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc2ccoc2c1 |r| Show InChI InChI=1S/C27H21Cl2N3O6S/c28-18-10-16-13-32(26(35)15-4-3-14-6-8-38-20(14)11-15)7-5-17(16)23(29)22(18)25(34)31-19(27(36)37)12-30-24(33)21-2-1-9-39-21/h1-4,6,8-11,19H,5,7,12-13H2,(H,30,33)(H,31,34)(H,36,37)/t19-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324810
((S)-2-(5,7-dichloro-2-(4-methylbenzoyl)-1,2,3,4-te...)Show SMILES Cc1ccc(cc1)C(=O)N1CCc2c(C1)cc(Cl)c(C(=O)N[C@@H](CNC(=O)c1cccs1)C(O)=O)c2Cl |r| Show InChI InChI=1S/C26H23Cl2N3O5S/c1-14-4-6-15(7-5-14)25(34)31-9-8-17-16(13-31)11-18(27)21(22(17)28)24(33)30-19(26(35)36)12-29-23(32)20-3-2-10-37-20/h2-7,10-11,19H,8-9,12-13H2,1H3,(H,29,32)(H,30,33)(H,35,36)/t19-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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 |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324823
((S)-2-(5,7-dichloro-2-(2,3-dihydrobenzofuran-6-car...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc2CCOc2c1 |r| Show InChI InChI=1S/C27H23Cl2N3O6S/c28-18-10-16-13-32(26(35)15-4-3-14-6-8-38-20(14)11-15)7-5-17(16)23(29)22(18)25(34)31-19(27(36)37)12-30-24(33)21-2-1-9-39-21/h1-4,9-11,19H,5-8,12-13H2,(H,30,33)(H,31,34)(H,36,37)/t19-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324812
((S)-2-(5,7-dichloro-2-(4-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H20Cl3N3O5S/c26-15-5-3-13(4-6-15)24(34)31-8-7-16-14(12-31)10-17(27)20(21(16)28)23(33)30-18(25(35)36)11-29-22(32)19-2-1-9-37-19/h1-6,9-10,18H,7-8,11-12H2,(H,29,32)(H,30,33)(H,35,36)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324806
((S,E)-2-(5,7-dichloro-2-(3-(furan-2-yl)acryloyl)-1...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)\C=C\c1ccco1 |r| Show InChI InChI=1S/C25H21Cl2N3O6S/c26-17-11-14-13-30(20(31)6-5-15-3-1-9-36-15)8-7-16(14)22(27)21(17)24(33)29-18(25(34)35)12-28-23(32)19-4-2-10-37-19/h1-6,9-11,18H,7-8,12-13H2,(H,28,32)(H,29,33)(H,34,35)/b6-5+/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324816
((S)-3-benzamido-2-(5,7-dichloro-2-(4-chlorobenzoyl...)Show SMILES OC(=O)[C@H](CNC(=O)c1ccccc1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H22Cl3N3O5/c28-18-8-6-16(7-9-18)26(36)33-11-10-19-17(14-33)12-20(29)22(23(19)30)25(35)32-21(27(37)38)13-31-24(34)15-4-2-1-3-5-15/h1-9,12,21H,10-11,13-14H2,(H,31,34)(H,32,35)(H,37,38)/t21-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50092956
(1-(4-Acetyl-piperazin-1-yl)-3-[4-(2-isopropyl-phen...)Show SMILES CC(C)c1ccccc1Sc1ccc(\C=C\C(=O)N2CCN(CC2)C(C)=O)cc1[N+]([O-])=O Show InChI InChI=1S/C24H27N3O4S/c1-17(2)20-6-4-5-7-22(20)32-23-10-8-19(16-21(23)27(30)31)9-11-24(29)26-14-12-25(13-15-26)18(3)28/h4-11,16-17H,12-15H2,1-3H3/b11-9+ | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324817
((S)-2-(5,7-dichloro-2-(4-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](CNC(=O)c1ccco1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H20Cl3N3O6/c26-15-5-3-13(4-6-15)24(34)31-8-7-16-14(12-31)10-17(27)20(21(16)28)23(33)30-18(25(35)36)11-29-22(32)19-2-1-9-37-19/h1-6,9-10,18H,7-8,11-12H2,(H,29,32)(H,30,33)(H,35,36)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 51 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324811
((S)-2-(5,7-dichloro-2-(3-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1cccc(Cl)c1 |r| Show InChI InChI=1S/C25H20Cl3N3O5S/c26-15-4-1-3-13(9-15)24(34)31-7-6-16-14(12-31)10-17(27)20(21(16)28)23(33)30-18(25(35)36)11-29-22(32)19-5-2-8-37-19/h1-5,8-10,18H,6-7,11-12H2,(H,29,32)(H,30,33)(H,35,36)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 66 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324824
((S)-2-(2-(benzofuran-2-carbonyl)-5,7-dichloro-1,2,...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1cc2ccccc2o1 |r| Show InChI InChI=1S/C27H21Cl2N3O6S/c28-17-10-15-13-32(26(35)20-11-14-4-1-2-5-19(14)38-20)8-7-16(15)23(29)22(17)25(34)31-18(27(36)37)12-30-24(33)21-6-3-9-39-21/h1-6,9-11,18H,7-8,12-13H2,(H,30,33)(H,31,34)(H,36,37)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 69 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324807
((S)-2-(2-benzoyl-5,7-dichloro-1,2,3,4-tetrahydrois...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C25H21Cl2N3O5S/c26-17-11-15-13-30(24(33)14-5-2-1-3-6-14)9-8-16(15)21(27)20(17)23(32)29-18(25(34)35)12-28-22(31)19-7-4-10-36-19/h1-7,10-11,18H,8-9,12-13H2,(H,28,31)(H,29,32)(H,34,35)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324809
((S)-2-(5,7-dichloro-2-(3-methylbenzoyl)-1,2,3,4-te...)Show SMILES Cc1cccc(c1)C(=O)N1CCc2c(C1)cc(Cl)c(C(=O)N[C@@H](CNC(=O)c1cccs1)C(O)=O)c2Cl |r| Show InChI InChI=1S/C26H23Cl2N3O5S/c1-14-4-2-5-15(10-14)25(34)31-8-7-17-16(13-31)11-18(27)21(22(17)28)24(33)30-19(26(35)36)12-29-23(32)20-6-3-9-37-20/h2-6,9-11,19H,7-8,12-13H2,1H3,(H,29,32)(H,30,33)(H,35,36)/t19-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324811
((S)-2-(5,7-dichloro-2-(3-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1cccc(Cl)c1 |r| Show InChI InChI=1S/C25H20Cl3N3O5S/c26-15-4-1-3-13(9-15)24(34)31-7-6-16-14(12-31)10-17(27)20(21(16)28)23(33)30-18(25(35)36)11-29-22(32)19-5-2-8-37-19/h1-5,8-10,18H,6-7,11-12H2,(H,29,32)(H,30,33)(H,35,36)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324822
((S)-2-(2-(benzofuran-6-carbonyl)-5,7-dichloro-1,2,...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc2ccoc2c1 |r| Show InChI InChI=1S/C27H21Cl2N3O6S/c28-18-10-16-13-32(26(35)15-4-3-14-6-8-38-20(14)11-15)7-5-17(16)23(29)22(18)25(34)31-19(27(36)37)12-30-24(33)21-2-1-9-39-21/h1-4,6,8-11,19H,5,7,12-13H2,(H,30,33)(H,31,34)(H,36,37)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324812
((S)-2-(5,7-dichloro-2-(4-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H20Cl3N3O5S/c26-15-5-3-13(4-6-15)24(34)31-8-7-16-14(12-31)10-17(27)20(21(16)28)23(33)30-18(25(35)36)11-29-22(32)19-2-1-9-37-19/h1-6,9-10,18H,7-8,11-12H2,(H,29,32)(H,30,33)(H,35,36)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 430 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324808
((S)-2-(5,7-dichloro-2-(2-methylbenzoyl)-1,2,3,4-te...)Show SMILES Cc1ccccc1C(=O)N1CCc2c(C1)cc(Cl)c(C(=O)N[C@@H](CNC(=O)c1cccs1)C(O)=O)c2Cl |r| Show InChI InChI=1S/C26H23Cl2N3O5S/c1-14-5-2-3-6-16(14)25(34)31-9-8-17-15(13-31)11-18(27)21(22(17)28)24(33)30-19(26(35)36)12-29-23(32)20-7-4-10-37-20/h2-7,10-11,19H,8-9,12-13H2,1H3,(H,29,32)(H,30,33)(H,35,36)/t19-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 460 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324815
((S)-3-(cyclohexanecarboxamido)-2-(5,7-dichloro-2-(...)Show SMILES OC(=O)[C@H](CNC(=O)C1CCCCC1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H28Cl3N3O5/c28-18-8-6-16(7-9-18)26(36)33-11-10-19-17(14-33)12-20(29)22(23(19)30)25(35)32-21(27(37)38)13-31-24(34)15-4-2-1-3-5-15/h6-9,12,15,21H,1-5,10-11,13-14H2,(H,31,34)(H,32,35)(H,37,38)/t21-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324816
((S)-3-benzamido-2-(5,7-dichloro-2-(4-chlorobenzoyl...)Show SMILES OC(=O)[C@H](CNC(=O)c1ccccc1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H22Cl3N3O5/c28-18-8-6-16(7-9-18)26(36)33-11-10-19-17(14-33)12-20(29)22(23(19)30)25(35)32-21(27(37)38)13-31-24(34)15-4-2-1-3-5-15/h1-9,12,21H,10-11,13-14H2,(H,31,34)(H,32,35)(H,37,38)/t21-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324814
((S)-3-acetamido-2-(5,7-dichloro-2-(4-chlorobenzoyl...)Show SMILES CC(=O)NC[C@H](NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1)C(O)=O |r| Show InChI InChI=1S/C22H20Cl3N3O5/c1-11(29)26-9-17(22(32)33)27-20(30)18-16(24)8-13-10-28(7-6-15(13)19(18)25)21(31)12-2-4-14(23)5-3-12/h2-5,8,17H,6-7,9-10H2,1H3,(H,26,29)(H,27,30)(H,32,33)/t17-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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 |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324823
((S)-2-(5,7-dichloro-2-(2,3-dihydrobenzofuran-6-car...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc2CCOc2c1 |r| Show InChI InChI=1S/C27H23Cl2N3O6S/c28-18-10-16-13-32(26(35)15-4-3-14-6-8-38-20(14)11-15)7-5-17(16)23(29)22(18)25(34)31-19(27(36)37)12-30-24(33)21-2-1-9-39-21/h1-4,9-11,19H,5-8,12-13H2,(H,30,33)(H,31,34)(H,36,37)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 650 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324819
((S)-2-(5,7-dichloro-2-(4-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C28H22Cl3N3O4/c29-18-7-5-15(6-8-18)27(36)34-10-9-20-17(14-34)11-21(30)24(25(20)31)26(35)33-23(28(37)38)12-16-13-32-22-4-2-1-3-19(16)22/h1-8,11,13,23,32H,9-10,12,14H2,(H,33,35)(H,37,38)/t23-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 810 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324821
((S)-2-(5,7-dichloro-2-(cyclohexanecarbonyl)-1,2,3,...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)C1CCCCC1 |r| Show InChI InChI=1S/C25H27Cl2N3O5S/c26-17-11-15-13-30(24(33)14-5-2-1-3-6-14)9-8-16(15)21(27)20(17)23(32)29-18(25(34)35)12-28-22(31)19-7-4-10-36-19/h4,7,10-11,14,18H,1-3,5-6,8-9,12-13H2,(H,28,31)(H,29,32)(H,34,35)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324820
((S)-2-(2-acetyl-5,7-dichloro-1,2,3,4-tetrahydroiso...)Show SMILES CC(=O)N1CCc2c(C1)cc(Cl)c(C(=O)N[C@@H](CNC(=O)c1cccs1)C(O)=O)c2Cl |r| Show InChI InChI=1S/C20H19Cl2N3O5S/c1-10(26)25-5-4-12-11(9-25)7-13(21)16(17(12)22)19(28)24-14(20(29)30)8-23-18(27)15-3-2-6-31-15/h2-3,6-7,14H,4-5,8-9H2,1H3,(H,23,27)(H,24,28)(H,29,30)/t14-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324818
((S)-2-(5,7-dichloro-2-(4-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](Cc1cccc(O)c1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H21Cl3N2O5/c27-17-6-4-15(5-7-17)25(34)31-9-8-19-16(13-31)12-20(28)22(23(19)29)24(33)30-21(26(35)36)11-14-2-1-3-18(32)10-14/h1-7,10,12,21,32H,8-9,11,13H2,(H,30,33)(H,35,36)/t21-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin beta-2/Intercellular adhesion molecule 1
(Homo sapiens (Human)) | BDBM50324813
((S)-3-amino-2-(5,7-dichloro-2-(4-chlorobenzoyl)-1,...)Show SMILES NC[C@H](NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1)C(O)=O |r| Show InChI InChI=1S/C20H18Cl3N3O4/c21-12-3-1-10(2-4-12)19(28)26-6-5-13-11(9-26)7-14(22)16(17(13)23)18(27)25-15(8-24)20(29)30/h1-4,7,15H,5-6,8-9,24H2,(H,25,27)(H,29,30)/t15-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1/ICAM1 interaction in human Hut-78 cells by cell migration assay |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324807
((S)-2-(2-benzoyl-5,7-dichloro-1,2,3,4-tetrahydrois...)Show SMILES OC(=O)[C@H](CNC(=O)c1cccs1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C25H21Cl2N3O5S/c26-17-11-15-13-30(24(33)14-5-2-1-3-6-14)9-8-16(15)21(27)20(17)23(32)29-18(25(34)35)12-28-22(31)19-7-4-10-36-19/h1-7,10-11,18H,8-9,12-13H2,(H,28,31)(H,29,32)(H,34,35)/t18-/m0/s1 | 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 | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324810
((S)-2-(5,7-dichloro-2-(4-methylbenzoyl)-1,2,3,4-te...)Show SMILES Cc1ccc(cc1)C(=O)N1CCc2c(C1)cc(Cl)c(C(=O)N[C@@H](CNC(=O)c1cccs1)C(O)=O)c2Cl |r| Show InChI InChI=1S/C26H23Cl2N3O5S/c1-14-4-6-15(7-5-14)25(34)31-9-8-17-16(13-31)11-18(27)21(22(17)28)24(33)30-19(26(35)36)12-29-23(32)20-3-2-10-37-20/h2-7,10-11,19H,8-9,12-13H2,1H3,(H,29,32)(H,30,33)(H,35,36)/t19-/m0/s1 | 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 | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324817
((S)-2-(5,7-dichloro-2-(4-chlorobenzoyl)-1,2,3,4-te...)Show SMILES OC(=O)[C@H](CNC(=O)c1ccco1)NC(=O)c1c(Cl)cc2CN(CCc2c1Cl)C(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H20Cl3N3O6/c26-15-5-3-13(4-6-15)24(34)31-8-7-16-14(12-31)10-17(27)20(21(16)28)23(33)30-18(25(35)36)11-29-22(32)19-2-1-9-37-19/h1-6,9-10,18H,7-8,11-12H2,(H,29,32)(H,30,33)(H,35,36)/t18-/m0/s1 | 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 | 3.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of LFA1-mediated Staphylococcal enterotoxin B-stimulated human T cell activation in presence of 10% fetal bovine serum |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
Integrin alpha-L
(Homo sapiens (Human)) | BDBM50324825
((R)-5-(4-bromobenzyl)-3-(3,5-dichlorophenyl)-5-met...)Show SMILES C[C@]1(Cc2ccc(Br)cc2)NC(=O)N(C1=O)c1cc(Cl)cc(Cl)c1 |r| Show InChI InChI=1S/C17H13BrCl2N2O2/c1-17(9-10-2-4-11(18)5-3-10)15(23)22(16(24)21-17)14-7-12(19)6-13(20)8-14/h2-8H,9H2,1H3,(H,21,24)/t17-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a |
Sunesis Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to LFA1 |
Bioorg Med Chem Lett 20: 5269-73 (2010)
Article DOI: 10.1016/j.bmcl.2010.06.145
BindingDB Entry DOI: 10.7270/Q2N58MKB |
More data for this
Ligand-Target Pair | |
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