Found 63 hits with Last Name = 'miyashita' and Initial = 'm' 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-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421472
(CHEMBL352388)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(=N)N1CCSC1)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C25H35FN4O4S/c1-4-20(25(2,3)24(34)29-9-7-16(8-10-29)13-21(31)32)28-23(33)18-6-5-17(14-19(18)26)22(27)30-11-12-35-15-30/h5-6,14,16,20,27H,4,7-13,15H2,1-3H3,(H,28,33)(H,31,32)/t20-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421428
(CHEMBL169928)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(=N)N1CCC(O)CC1)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C27H39FN4O5/c1-4-22(27(2,3)26(37)32-11-7-17(8-12-32)15-23(34)35)30-25(36)20-6-5-18(16-21(20)28)24(29)31-13-9-19(33)10-14-31/h5-6,16-17,19,22,29,33H,4,7-15H2,1-3H3,(H,30,36)(H,34,35)/t22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421439
(CHEMBL424205)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C22H31FN4O4/c1-4-17(26-20(30)15-6-5-14(19(24)25)12-16(15)23)22(2,3)21(31)27-9-7-13(8-10-27)11-18(28)29/h5-6,12-13,17H,4,7-11H2,1-3H3,(H3,24,25)(H,26,30)(H,28,29)/t17-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421450
(CHEMBL353902)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(=N)N1CCN(C)CC1)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C27H40FN5O4/c1-5-22(27(2,3)26(37)33-10-8-18(9-11-33)16-23(34)35)30-25(36)20-7-6-19(17-21(20)28)24(29)32-14-12-31(4)13-15-32/h6-7,17-18,22,29H,5,8-16H2,1-4H3,(H,30,36)(H,34,35)/t22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421447
(CHEMBL169139)Show SMILES CCCC[C@@H](NC(=O)c1ccc(cc1F)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C24H35FN4O4/c1-4-5-6-19(28-22(32)17-8-7-16(21(26)27)14-18(17)25)24(2,3)23(33)29-11-9-15(10-12-29)13-20(30)31/h7-8,14-15,19H,4-6,9-13H2,1-3H3,(H3,26,27)(H,28,32)(H,30,31)/t19-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421436
(CHEMBL168328)Show SMILES CC(C)([C@H](NC(=O)c1ccc(cc1)C(N)=N)c1cccc(O)c1)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H32N4O5/c1-26(2,25(35)30-12-10-16(11-13-30)14-21(32)33)22(19-4-3-5-20(31)15-19)29-24(34)18-8-6-17(7-9-18)23(27)28/h3-9,15-16,22,31H,10-14H2,1-2H3,(H3,27,28)(H,29,34)(H,32,33)/t22-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
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DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421444
(CHEMBL172627)Show SMILES C[C@@H](NC(=O)c1ccc(cc1F)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C21H29FN4O4/c1-12(25-19(29)15-5-4-14(18(23)24)11-16(15)22)21(2,3)20(30)26-8-6-13(7-9-26)10-17(27)28/h4-5,11-13H,6-10H2,1-3H3,(H3,23,24)(H,25,29)(H,27,28)/t12-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421481
(CHEMBL169819)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(=N)N1CCN(CC1)c1ccc(F)cc1)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C32H41F2N5O4/c1-4-27(32(2,3)31(43)39-13-11-21(12-14-39)19-28(40)41)36-30(42)25-10-5-22(20-26(25)34)29(35)38-17-15-37(16-18-38)24-8-6-23(33)7-9-24/h5-10,20-21,27,35H,4,11-19H2,1-3H3,(H,36,42)(H,40,41)/t27-/m1/s1 | PDB
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antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421467
(CHEMBL170607)Show SMILES CCC[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C23H34N4O4/c1-4-5-18(26-21(30)17-8-6-16(7-9-17)20(24)25)23(2,3)22(31)27-12-10-15(11-13-27)14-19(28)29/h6-9,15,18H,4-5,10-14H2,1-3H3,(H3,24,25)(H,26,30)(H,28,29)/t18-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421464
(CHEMBL169547)Show SMILES CCCC[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C24H36N4O4/c1-4-5-6-19(27-22(31)18-9-7-17(8-10-18)21(25)26)24(2,3)23(32)28-13-11-16(12-14-28)15-20(29)30/h7-10,16,19H,4-6,11-15H2,1-3H3,(H3,25,26)(H,27,31)(H,29,30)/t19-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421459
(CHEMBL172679)Show SMILES CC(C)C[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C24H36N4O4/c1-15(2)13-19(27-22(31)18-7-5-17(6-8-18)21(25)26)24(3,4)23(32)28-11-9-16(10-12-28)14-20(29)30/h5-8,15-16,19H,9-14H2,1-4H3,(H3,25,26)(H,27,31)(H,29,30)/t19-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421487
(CHEMBL169585)Show SMILES C[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C21H30N4O4/c1-13(24-19(28)16-6-4-15(5-7-16)18(22)23)21(2,3)20(29)25-10-8-14(9-11-25)12-17(26)27/h4-7,13-14H,8-12H2,1-3H3,(H3,22,23)(H,24,28)(H,26,27)/t13-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421437
(CHEMBL169493)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C22H32N4O4/c1-4-17(25-20(29)16-7-5-15(6-8-16)19(23)24)22(2,3)21(30)26-11-9-14(10-12-26)13-18(27)28/h5-8,14,17H,4,9-13H2,1-3H3,(H3,23,24)(H,25,29)(H,27,28)/t17-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421443
(CHEMBL169215)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(=N)N1CCCC1)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H37FN4O4/c1-4-21(26(2,3)25(35)31-13-9-17(10-14-31)15-22(32)33)29-24(34)19-8-7-18(16-20(19)27)23(28)30-11-5-6-12-30/h7-8,16-17,21,28H,4-6,9-15H2,1-3H3,(H,29,34)(H,32,33)/t21-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421429
(CHEMBL172100)Show SMILES CC(C)[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C23H34N4O4/c1-14(2)19(26-21(30)17-7-5-16(6-8-17)20(24)25)23(3,4)22(31)27-11-9-15(10-12-27)13-18(28)29/h5-8,14-15,19H,9-13H2,1-4H3,(H3,24,25)(H,26,30)(H,28,29)/t19-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 76 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421456
(CHEMBL169671)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(=N)N1CCOCC1)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H37FN4O5/c1-4-21(26(2,3)25(35)31-9-7-17(8-10-31)15-22(32)33)29-24(34)19-6-5-18(16-20(19)27)23(28)30-11-13-36-14-12-30/h5-6,16-17,21,28H,4,7-15H2,1-3H3,(H,29,34)(H,32,33)/t21-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421476
(CHEMBL171831)Show SMILES CCCCC[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C25H38N4O4/c1-4-5-6-7-20(28-23(32)19-10-8-18(9-11-19)22(26)27)25(2,3)24(33)29-14-12-17(13-15-29)16-21(30)31/h8-11,17,20H,4-7,12-16H2,1-3H3,(H3,26,27)(H,28,32)(H,30,31)/t20-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421480
(CHEMBL354325)Show SMILES CC(C)([C@@H](CCc1ccccc1)NC(=O)c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C28H36N4O4/c1-28(2,27(36)32-16-14-20(15-17-32)18-24(33)34)23(13-8-19-6-4-3-5-7-19)31-26(35)22-11-9-21(10-12-22)25(29)30/h3-7,9-12,20,23H,8,13-18H2,1-2H3,(H3,29,30)(H,31,35)(H,33,34)/t23-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421475
(CHEMBL171053)Show SMILES C\C=C\[C@@H](NC(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C23H32N4O4/c1-4-5-18(26-21(30)17-8-6-16(7-9-17)20(24)25)23(2,3)22(31)27-12-10-15(11-13-27)14-19(28)29/h4-9,15,18H,10-14H2,1-3H3,(H3,24,25)(H,26,30)(H,28,29)/b5-4+/t18-/m1/s1 | PDB
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| n/a | n/a | 85 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421448
(CHEMBL172270)Show SMILES CC(C)([C@H](NC(=O)c1ccc(cc1)C(N)=N)c1ccc(O)cc1)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H32N4O5/c1-26(2,25(35)30-13-11-16(12-14-30)15-21(32)33)22(17-7-9-20(31)10-8-17)29-24(34)19-5-3-18(4-6-19)23(27)28/h3-10,16,22,31H,11-15H2,1-2H3,(H3,27,28)(H,29,34)(H,32,33)/t22-/m1/s1 | PDB
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| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421457
(CHEMBL169984)Show SMILES CC(C)([C@H](NC(=O)c1ccc(cc1)C(N)=N)c1ccccc1)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H32N4O4/c1-26(2,25(34)30-14-12-17(13-15-30)16-21(31)32)22(18-6-4-3-5-7-18)29-24(33)20-10-8-19(9-11-20)23(27)28/h3-11,17,22H,12-16H2,1-2H3,(H3,27,28)(H,29,33)(H,31,32)/t22-/m1/s1 | PDB
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| n/a | n/a | 115 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421442
(CHEMBL431177)Show SMILES COC(\C=C\c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C22H31N3O4/c1-22(2,21(28)25-12-10-16(11-13-25)14-19(26)27)18(29-3)9-6-15-4-7-17(8-5-15)20(23)24/h4-9,16,18H,10-14H2,1-3H3,(H3,23,24)(H,26,27)/b9-6+ | PDB
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| n/a | n/a | 126 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421452
(CHEMBL170108)Show SMILES CC(C)([C@H](NC(=O)c1ccc(cc1)C(N)=N)c1cccc(Cl)c1)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H31ClN4O4/c1-26(2,25(35)31-12-10-16(11-13-31)14-21(32)33)22(19-4-3-5-20(27)15-19)30-24(34)18-8-6-17(7-9-18)23(28)29/h3-9,15-16,22H,10-14H2,1-2H3,(H3,28,29)(H,30,34)(H,32,33)/t22-/m1/s1 | PDB
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| n/a | n/a | 126 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421446
(CHEMBL67254)Show SMILES CCOC(\C=C\c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C23H33N3O4/c1-4-30-19(10-7-16-5-8-18(9-6-16)21(24)25)23(2,3)22(29)26-13-11-17(12-14-26)15-20(27)28/h5-10,17,19H,4,11-15H2,1-3H3,(H3,24,25)(H,27,28)/b10-7+ | PDB
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| n/a | n/a | 129 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421449
(CHEMBL351620)Show SMILES CC(C)(C(OCC=C)\C=C\c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C24H33N3O4/c1-4-15-31-20(10-7-17-5-8-19(9-6-17)22(25)26)24(2,3)23(30)27-13-11-18(12-14-27)16-21(28)29/h4-10,18,20H,1,11-16H2,2-3H3,(H3,25,26)(H,28,29)/b10-7+ | PDB
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| n/a | n/a | 135 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421473
(CHEMBL424570)Show SMILES CN([C@H](c1ccccc1)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1)C(=O)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C27H34N4O4/c1-27(2,26(35)31-15-13-18(14-16-31)17-22(32)33)23(19-7-5-4-6-8-19)30(3)25(34)21-11-9-20(10-12-21)24(28)29/h4-12,18,23H,13-17H2,1-3H3,(H3,28,29)(H,32,33)/t23-/m1/s1 | PDB
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| n/a | n/a | 151 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421488
(CHEMBL350415)Show SMILES CC(C)([C@H](NC(=O)c1ccc(cc1Cl)C(N)=N)c1ccccc1)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H31ClN4O4/c1-26(2,25(35)31-12-10-16(11-13-31)14-21(32)33)22(17-6-4-3-5-7-17)30-24(34)19-9-8-18(23(28)29)15-20(19)27/h3-9,15-16,22H,10-14H2,1-2H3,(H3,28,29)(H,30,34)(H,32,33)/t22-/m1/s1 | PDB
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| n/a | n/a | 186 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421434
(CHEMBL367194)Show SMILES CC(C)([C@H](NC(=O)c1ccc(cc1)C(N)=N)c1ccc2ccccc2c1)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C30H34N4O4/c1-30(2,29(38)34-15-13-19(14-16-34)17-25(35)36)26(24-12-7-20-5-3-4-6-23(20)18-24)33-28(37)22-10-8-21(9-11-22)27(31)32/h3-12,18-19,26H,13-17H2,1-2H3,(H3,31,32)(H,33,37)(H,35,36)/t26-/m1/s1 | PDB
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| n/a | n/a | 191 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50064936
(CHEMBL63360 | {1-[(E)-5-(4-Carbamimidoyl-phenyl)-2...)Show SMILES CC(C)(\C=C\C(=O)c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C21H27N3O4/c1-21(2,20(28)24-11-8-14(9-12-24)13-18(26)27)10-7-17(25)15-3-5-16(6-4-15)19(22)23/h3-7,10,14H,8-9,11-13H2,1-2H3,(H3,22,23)(H,26,27)/b10-7+ | PDB
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| n/a | n/a | 209 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421486
(CHEMBL67626)Show SMILES COC(CCc1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C22H33N3O4/c1-22(2,21(28)25-12-10-16(11-13-25)14-19(26)27)18(29-3)9-6-15-4-7-17(8-5-15)20(23)24/h4-5,7-8,16,18H,6,9-14H2,1-3H3,(H3,23,24)(H,26,27) | PDB
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| PubMed
| n/a | n/a | 240 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421479
(CHEMBL68449)Show SMILES CC(C)(C(O)\C=C\c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C21H29N3O4/c1-21(2,20(28)24-11-9-15(10-12-24)13-18(26)27)17(25)8-5-14-3-6-16(7-4-14)19(22)23/h3-8,15,17,25H,9-13H2,1-2H3,(H3,22,23)(H,26,27)/b8-5+ | PDB
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| n/a | n/a | 302 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421458
(CHEMBL353150)Show SMILES CC(C)([C@H](NC(=O)c1ccc(cc1)C(N)=N)c1ccc(Cl)cc1)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H31ClN4O4/c1-26(2,25(35)31-13-11-16(12-14-31)15-21(32)33)22(17-7-9-20(27)10-8-17)30-24(34)19-5-3-18(4-6-19)23(28)29/h3-10,16,22H,11-15H2,1-2H3,(H3,28,29)(H,30,34)(H,32,33)/t22-/m1/s1 | PDB
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| PubMed
| n/a | n/a | 331 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421484
(CHEMBL68130)Show SMILES CC(C)(C(OCc1ccccc1)\C=C\c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C28H35N3O4/c1-28(2,27(34)31-16-14-21(15-17-31)18-25(32)33)24(35-19-22-6-4-3-5-7-22)13-10-20-8-11-23(12-9-20)26(29)30/h3-13,21,24H,14-19H2,1-2H3,(H3,29,30)(H,32,33)/b13-10+ | PDB
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| PubMed
| n/a | n/a | 363 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421440
(CHEMBL355201)Show SMILES CCCCNC(=N)c1ccc(C(=O)N[C@H](CC)C(C)(C)C(=O)N2CCC(CC(O)=O)CC2)c(F)c1 Show InChI InChI=1S/C26H39FN4O4/c1-5-7-12-29-23(28)18-8-9-19(20(27)16-18)24(34)30-21(6-2)26(3,4)25(35)31-13-10-17(11-14-31)15-22(32)33/h8-9,16-17,21H,5-7,10-15H2,1-4H3,(H2,28,29)(H,30,34)(H,32,33)/t21-/m1/s1 | PDB
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| PubMed
| n/a | n/a | 501 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50064933
(CHEMBL68074 | {1-[3-(4-Carbamimidoyl-benzoylamino)...)Show SMILES CC(C)(CNC(=O)c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C20H28N4O4/c1-20(2,19(28)24-9-7-13(8-10-24)11-16(25)26)12-23-18(27)15-5-3-14(4-6-15)17(21)22/h3-6,13H,7-12H2,1-2H3,(H3,21,22)(H,23,27)(H,25,26) | PDB
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| n/a | n/a | 575 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421455
(CHEMBL66261)Show SMILES CC(C)(CCC(=O)c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C21H29N3O4/c1-21(2,20(28)24-11-8-14(9-12-24)13-18(26)27)10-7-17(25)15-3-5-16(6-4-15)19(22)23/h3-6,14H,7-13H2,1-2H3,(H3,22,23)(H,26,27) | PDB
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| n/a | n/a | 631 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421466
(CHEMBL355090)Show SMILES CCCC[C@@H](N(CC#C)C(=O)c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C27H38N4O4/c1-5-7-8-22(27(3,4)26(35)30-16-13-19(14-17-30)18-23(32)33)31(15-6-2)25(34)21-11-9-20(10-12-21)24(28)29/h2,9-12,19,22H,5,7-8,13-18H2,1,3-4H3,(H3,28,29)(H,32,33)/t22-/m1/s1 | PDB
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| n/a | n/a | 708 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421431
(CHEMBL66386)Show SMILES CCCCCCOC(\C=C\c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C27H41N3O4/c1-4-5-6-7-18-34-23(13-10-20-8-11-22(12-9-20)25(28)29)27(2,3)26(33)30-16-14-21(15-17-30)19-24(31)32/h8-13,21,23H,4-7,14-19H2,1-3H3,(H3,28,29)(H,31,32)/b13-10+ | PDB
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| n/a | n/a | 794 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
Inhibition of alphaV-beta3 mediated cell adhesion |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421477
(CHEMBL355010)Show SMILES CC[C@@H](NC(=O)c1ccc(cc1F)C(=N)N(CC)CC)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C26H39FN4O4/c1-6-21(26(4,5)25(35)31-13-11-17(12-14-31)15-22(32)33)29-24(34)19-10-9-18(16-20(19)27)23(28)30(7-2)8-3/h9-10,16-17,21,28H,6-8,11-15H2,1-5H3,(H,29,34)(H,32,33)/t21-/m1/s1 | PDB
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| n/a | n/a | 1.66E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421435
(CHEMBL63562)Show SMILES NC(=N)c1ccc(cc1)C(=O)N[C@@H](CC(=O)N1CCC(CC(O)=O)CC1)C(=O)OC1CCCCC1 Show InChI InChI=1S/C25H34N4O6/c26-23(27)17-6-8-18(9-7-17)24(33)28-20(25(34)35-19-4-2-1-3-5-19)15-21(30)29-12-10-16(11-13-29)14-22(31)32/h6-9,16,19-20H,1-5,10-15H2,(H3,26,27)(H,28,33)(H,31,32)/t20-/m0/s1 | PDB
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| n/a | n/a | 1.91E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421454
(CHEMBL64969)Show SMILES NC(=N)c1ccc(cc1)C(=O)NCCC(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C18H24N4O4/c19-17(20)13-1-3-14(4-2-13)18(26)21-8-5-15(23)22-9-6-12(7-10-22)11-16(24)25/h1-4,12H,5-11H2,(H3,19,20)(H,21,26)(H,24,25) | PDB
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| n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421438
(CHEMBL63143)Show SMILES CC(C)(C(=O)\C=C\c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C21H27N3O4/c1-21(2,20(28)24-11-9-15(10-12-24)13-18(26)27)17(25)8-5-14-3-6-16(7-4-14)19(22)23/h3-8,15H,9-13H2,1-2H3,(H3,22,23)(H,26,27)/b8-5+ | PDB
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| n/a | n/a | 3.47E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421445
(CHEMBL307082)Show SMILES NC(=N)c1ccc(cc1)C(=O)N[C@@H](CC(=O)N1CCC(CC(O)=O)CC1)C(=O)Oc1ccccc1 Show InChI InChI=1S/C25H28N4O6/c26-23(27)17-6-8-18(9-7-17)24(33)28-20(25(34)35-19-4-2-1-3-5-19)15-21(30)29-12-10-16(11-13-29)14-22(31)32/h1-9,16,20H,10-15H2,(H3,26,27)(H,28,33)(H,31,32)/t20-/m0/s1 | PDB
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| n/a | n/a | 4.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421465
(CHEMBL294057)Show SMILES C[C@@H](CC(=O)N1CCC(CC(O)=O)CC1)NC(=O)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C19H26N4O4/c1-12(22-19(27)15-4-2-14(3-5-15)18(20)21)10-16(24)23-8-6-13(7-9-23)11-17(25)26/h2-5,12-13H,6-11H2,1H3,(H3,20,21)(H,22,27)(H,25,26)/t12-/m0/s1 | PDB
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| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421474
(CHEMBL63177)Show SMILES NC(=N)c1ccc(cc1)C(=O)N[C@H](CC(=O)N1CCC(CC(O)=O)CC1)c1ccccc1 Show InChI InChI=1S/C24H28N4O4/c25-23(26)18-6-8-19(9-7-18)24(32)27-20(17-4-2-1-3-5-17)15-21(29)28-12-10-16(11-13-28)14-22(30)31/h1-9,16,20H,10-15H2,(H3,25,26)(H,27,32)(H,30,31)/t20-/m1/s1 | PDB
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| n/a | n/a | 5.25E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421485
(CHEMBL67124)Show SMILES CN(CCC(=O)N1CCC(CC(O)=O)CC1)C(=O)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C19H26N4O4/c1-22(19(27)15-4-2-14(3-5-15)18(20)21)9-8-16(24)23-10-6-13(7-11-23)12-17(25)26/h2-5,13H,6-12H2,1H3,(H3,20,21)(H,25,26) | PDB
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| n/a | n/a | 6.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421460
(CHEMBL63665)Show SMILES CN(CC(=O)N1CCC(CC(O)=O)CC1)C(=O)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C18H24N4O4/c1-21(18(26)14-4-2-13(3-5-14)17(19)20)11-15(23)22-8-6-12(7-9-22)10-16(24)25/h2-5,12H,6-11H2,1H3,(H3,19,20)(H,24,25) | PDB
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| n/a | n/a | 7.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421471
(CHEMBL443527)Show SMILES CC(C)[C@@H](CC(=O)N1CCC(CC(O)=O)CC1)NC(=O)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C21H30N4O4/c1-13(2)17(24-21(29)16-5-3-15(4-6-16)20(22)23)12-18(26)25-9-7-14(8-10-25)11-19(27)28/h3-6,13-14,17H,7-12H2,1-2H3,(H3,22,23)(H,24,29)(H,27,28)/t17-/m1/s1 | PDB
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| n/a | n/a | 9.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421482
(CHEMBL169477)Show SMILES NC(=N)c1ccc(cc1)C(=O)NCCC(=O)N1CCC(COC(O)=O)CC1 Show InChI InChI=1S/C18H24N4O5/c19-16(20)13-1-3-14(4-2-13)17(24)21-8-5-15(23)22-9-6-12(7-10-22)11-27-18(25)26/h1-4,12H,5-11H2,(H3,19,20)(H,21,24)(H,25,26) | PDB
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| n/a | n/a | 1.82E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50421462
(CHEMBL302613)Show SMILES C[C@H](NC(=O)c1ccc(cc1)C(N)=N)C(=O)N1CCC(CC(O)=O)CC1 Show InChI InChI=1S/C18H24N4O4/c1-11(18(26)22-8-6-12(7-9-22)10-15(23)24)21-17(25)14-4-2-13(3-5-14)16(19)20/h2-5,11-12H,6-10H2,1H3,(H3,19,20)(H,21,25)(H,23,24)/t11-/m0/s1 | PDB
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| n/a | n/a | 3.02E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description
The compound was tested for its inhibitory activity against platelet aggregation |
Bioorg Med Chem Lett 10: 859-63 (2000)
BindingDB Entry DOI: 10.7270/Q2W95BFN |
More data for this
Ligand-Target Pair | |
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