Found 69 hits with Last Name = 'chatterjee' and Initial = 'j' 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 |
|---|
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50051568
((3S,6S,9S,12R,15S,18S)-9-(4-Amino-butyl)-3-benzyl-...)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O Show InChI InChI=1S/C44H56N8O7/c1-26(2)38-43(58)50-37(23-28-12-6-5-7-13-28)44(59)52(4)27(3)39(54)48-35(22-29-17-19-31(53)20-18-29)41(56)49-36(24-30-25-46-33-15-9-8-14-32(30)33)42(57)47-34(40(55)51-38)16-10-11-21-45/h5-9,12-15,17-20,25-27,34-38,46,53H,10-11,16,21-24,45H2,1-4H3,(H,47,57)(H,48,54)(H,49,56)(H,50,58)(H,51,55)/t27-,34-,35-,36+,37-,38-/m0/s1 | PDB
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GoogleScholar
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50378998
(CHEMBL2011465)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-43(58)50-36(24-30-14-8-7-9-15-30)44(59)52(4)29(3)41(56)49-37(25-31-19-21-33(55)22-20-31)45(60)54(6)39(26-32-27-48-35-17-11-10-16-34(32)35)46(61)53(5)38(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,58)(H,51,57)/t29-,36-,37-,38-,39+,40-/m0/s1 | PDB
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| n/a | n/a | 3.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50379004
(CHEMBL2011466)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)49-36(24-31-19-21-33(55)22-20-31)42(57)50-37(26-32-27-48-35-17-11-10-16-34(32)35)44(59)53(5)38(43(58)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,57)(H,51,58)/t29-,36-,37+,38-,39-,40-/m0/s1 | PDB
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UniChem
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| n/a | n/a | 4.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50378999
(CHEMBL2011464)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)48-35(23-30-18-20-32(54)21-19-30)41(56)49-37(25-31-26-47-34-16-10-9-15-33(31)34)45(60)53(5)38(42(57)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,55)(H,49,56)(H,50,58)(H,51,57)/t28-,35-,36-,37+,38-,39-/m0/s1 | PDB
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PC cid
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| n/a | n/a | 4.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50379000
(CHEMBL2011463)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-45(60)53(5)38(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-36(23-30-18-20-32(54)21-19-30)42(57)50-37(25-31-26-47-34-16-10-9-15-33(31)34)43(58)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,58)(H,49,55)(H,50,57)(H,51,56)/t28-,35-,36-,37+,38-,39-/m0/s1 | PDB
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 4.40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50379001
(CHEMBL2011462)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(23-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-37(24-30-18-20-32(54)21-19-30)45(60)53(5)38(25-31-26-47-34-16-10-9-15-33(31)34)42(57)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,57)(H,49,55)(H,50,58)(H,51,56)/t28-,35-,36-,37-,38+,39-/m0/s1 | PDB
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UniChem
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| n/a | n/a | 5.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50225987
(CHEMBL237056 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7](-[#6])-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C30H45N9O8/c1-17(2)12-19-26(44)35-16-24(41)39(3)22(10-7-11-33-30(31)32)29(47)34-15-23(40)36-21(14-25(42)43)28(46)38-20(27(45)37-19)13-18-8-5-4-6-9-18/h4-6,8-9,17,19-22H,7,10-16H2,1-3H3,(H,34,47)(H,35,44)(H,36,40)(H,37,45)(H,38,46)(H,42,43)(H4,31,32,33)/t19-,20+,21-,22-/m0/s1 | PDB
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PC cid
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UniChem
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| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha2bbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50225994
(CHEMBL237057 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7](-[#6])-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7](-[#6])-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C31H47N9O8/c1-18(2)13-23-29(47)36-17-25(42)39(3)22(11-8-12-34-31(32)33)28(46)35-16-24(41)37-20(15-26(43)44)27(45)38-21(30(48)40(23)4)14-19-9-6-5-7-10-19/h5-7,9-10,18,20-23H,8,11-17H2,1-4H3,(H,35,46)(H,36,47)(H,37,41)(H,38,45)(H,43,44)(H4,32,33,34)/t20-,21+,22-,23-/m0/s1 | PDB
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PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha2bbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50225991
(CHEMBL391340 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7](-[#6])-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7](-[#6])-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7](-[#6])-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C32H49N9O8/c1-19(2)14-23-29(47)37-18-26(43)39(3)22(12-9-13-35-32(33)34)28(46)36-17-25(42)38-21(16-27(44)45)30(48)41(5)24(31(49)40(23)4)15-20-10-7-6-8-11-20/h6-8,10-11,19,21-24H,9,12-18H2,1-5H3,(H,36,46)(H,37,47)(H,38,42)(H,44,45)(H4,33,34,35)/t21-,22-,23-,24+/m0/s1 | PDB
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antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha2bbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50379002
(CHEMBL2011467)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C47H62N8O7/c1-29(2)41-47(62)55(7)39(26-31-15-9-8-10-16-31)45(60)52(4)30(3)42(57)50-37(25-32-20-22-34(56)23-21-32)44(59)54(6)40(27-33-28-49-36-18-12-11-17-35(33)36)46(61)53(5)38(43(58)51-41)19-13-14-24-48/h8-12,15-18,20-23,28-30,37-41,49,56H,13-14,19,24-27,48H2,1-7H3,(H,50,57)(H,51,58)/t30-,37-,38-,39-,40+,41-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 2
(Homo sapiens (Human)) | BDBM50379003
(CHEMBL2011461)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)50-37(24-31-19-21-33(55)22-20-31)44(59)53(5)38(26-32-27-48-35-17-11-10-16-34(32)35)43(58)49-36(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,58)(H,50,56)(H,51,57)/t29-,36-,37-,38+,39-,40-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst2 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50379000
(CHEMBL2011463)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-45(60)53(5)38(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-36(23-30-18-20-32(54)21-19-30)42(57)50-37(25-31-26-47-34-16-10-9-15-33(31)34)43(58)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,58)(H,49,55)(H,50,57)(H,51,56)/t28-,35-,36-,37+,38-,39-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50379003
(CHEMBL2011461)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)50-37(24-31-19-21-33(55)22-20-31)44(59)53(5)38(26-32-27-48-35-17-11-10-16-34(32)35)43(58)49-36(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,58)(H,50,56)(H,51,57)/t29-,36-,37-,38+,39-,40-/m0/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 76 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50051568
((3S,6S,9S,12R,15S,18S)-9-(4-Amino-butyl)-3-benzyl-...)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O Show InChI InChI=1S/C44H56N8O7/c1-26(2)38-43(58)50-37(23-28-12-6-5-7-13-28)44(59)52(4)27(3)39(54)48-35(22-29-17-19-31(53)20-18-29)41(56)49-36(24-30-25-46-33-15-9-8-14-32(30)33)42(57)47-34(40(55)51-38)16-10-11-21-45/h5-9,12-15,17-20,25-27,34-38,46,53H,10-11,16,21-24,45H2,1-4H3,(H,47,57)(H,48,54)(H,49,56)(H,50,58)(H,51,55)/t27-,34-,35-,36+,37-,38-/m0/s1 | Reactome pathway
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| n/a | n/a | 81 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50379003
(CHEMBL2011461)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)50-37(24-31-19-21-33(55)22-20-31)44(59)53(5)38(26-32-27-48-35-17-11-10-16-34(32)35)43(58)49-36(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,58)(H,50,56)(H,51,57)/t29-,36-,37-,38+,39-,40-/m0/s1 | Reactome pathway
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| n/a | n/a | 82 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50379000
(CHEMBL2011463)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-45(60)53(5)38(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-36(23-30-18-20-32(54)21-19-30)42(57)50-37(25-31-26-47-34-16-10-9-15-33(31)34)43(58)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,58)(H,49,55)(H,50,57)(H,51,56)/t28-,35-,36-,37+,38-,39-/m0/s1 | Reactome pathway
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| n/a | n/a | 98 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Integrin alpha-V/beta-3
(Homo sapiens (Human)) | BDBM50225988
(CHEMBL235999 | c(-GRGDfL-))Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C29H43N9O8/c1-16(2)11-19-26(44)34-14-22(39)35-18(9-6-10-32-29(30)31)25(43)33-15-23(40)36-21(13-24(41)42)28(46)38-20(27(45)37-19)12-17-7-4-3-5-8-17/h3-5,7-8,16,18-21H,6,9-15H2,1-2H3,(H,33,43)(H,34,44)(H,35,39)(H,36,40)(H,37,45)(H,38,46)(H,41,42)(H4,30,31,32)/t18-,19-,20+,21-/m0/s1 | PDB
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| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alphavbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Integrin alpha-V/beta-3
(Homo sapiens (Human)) | BDBM50225993
(CHEMBL394389 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7](-[#6])-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C30H45N9O8/c1-17(2)12-22-28(46)35-16-23(40)36-19(10-7-11-33-30(31)32)26(44)34-15-24(41)37-20(14-25(42)43)27(45)38-21(29(47)39(22)3)13-18-8-5-4-6-9-18/h4-6,8-9,17,19-22H,7,10-16H2,1-3H3,(H,34,44)(H,35,46)(H,36,40)(H,37,41)(H,38,45)(H,42,43)(H4,31,32,33)/t19-,20-,21+,22-/m0/s1 | PDB
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| n/a | n/a | 103 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alphavbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50051568
((3S,6S,9S,12R,15S,18S)-9-(4-Amino-butyl)-3-benzyl-...)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O Show InChI InChI=1S/C44H56N8O7/c1-26(2)38-43(58)50-37(23-28-12-6-5-7-13-28)44(59)52(4)27(3)39(54)48-35(22-29-17-19-31(53)20-18-29)41(56)49-36(24-30-25-46-33-15-9-8-14-32(30)33)42(57)47-34(40(55)51-38)16-10-11-21-45/h5-9,12-15,17-20,25-27,34-38,46,53H,10-11,16,21-24,45H2,1-4H3,(H,47,57)(H,48,54)(H,49,56)(H,50,58)(H,51,55)/t27-,34-,35-,36+,37-,38-/m0/s1 | Reactome pathway
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| n/a | n/a | 105 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50379001
(CHEMBL2011462)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(23-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-37(24-30-18-20-32(54)21-19-30)45(60)53(5)38(25-31-26-47-34-16-10-9-15-33(31)34)42(57)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,57)(H,49,55)(H,50,58)(H,51,56)/t28-,35-,36-,37-,38+,39-/m0/s1 | Reactome pathway
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| n/a | n/a | 126 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50379004
(CHEMBL2011466)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)49-36(24-31-19-21-33(55)22-20-31)42(57)50-37(26-32-27-48-35-17-11-10-16-34(32)35)44(59)53(5)38(43(58)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,57)(H,51,58)/t29-,36-,37+,38-,39-,40-/m0/s1 | Reactome pathway
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| n/a | n/a | 137 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50225989
(CHEMBL237272 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7](-[#6])-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7](-[#6])-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C31H47N9O8/c1-18(2)13-20-27(45)36-17-25(42)39(3)22(11-8-12-34-31(32)33)28(46)35-16-24(41)37-21(15-26(43)44)30(48)40(4)23(29(47)38-20)14-19-9-6-5-7-10-19/h5-7,9-10,18,20-23H,8,11-17H2,1-4H3,(H,35,46)(H,36,45)(H,37,41)(H,38,47)(H,43,44)(H4,32,33,34)/t20-,21-,22-,23+/m0/s1 | PDB
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| n/a | n/a | 165 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha2bbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50378998
(CHEMBL2011465)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-43(58)50-36(24-30-14-8-7-9-15-30)44(59)52(4)29(3)41(56)49-37(25-31-19-21-33(55)22-20-31)45(60)54(6)39(26-32-27-48-35-17-11-10-16-34(32)35)46(61)53(5)38(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,58)(H,51,57)/t29-,36-,37-,38-,39+,40-/m0/s1 | Reactome pathway
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| n/a | n/a | 172 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50379004
(CHEMBL2011466)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)49-36(24-31-19-21-33(55)22-20-31)42(57)50-37(26-32-27-48-35-17-11-10-16-34(32)35)44(59)53(5)38(43(58)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,57)(H,51,58)/t29-,36-,37+,38-,39-,40-/m0/s1 | Reactome pathway
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| n/a | n/a | 175 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50225988
(CHEMBL235999 | c(-GRGDfL-))Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C29H43N9O8/c1-16(2)11-19-26(44)34-14-22(39)35-18(9-6-10-32-29(30)31)25(43)33-15-23(40)36-21(13-24(41)42)28(46)38-20(27(45)37-19)12-17-7-4-3-5-8-17/h3-5,7-8,16,18-21H,6,9-15H2,1-2H3,(H,33,43)(H,34,44)(H,35,39)(H,36,40)(H,37,45)(H,38,46)(H,41,42)(H4,30,31,32)/t18-,19-,20+,21-/m0/s1 | PDB
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| n/a | n/a | 195 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha2bbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50378998
(CHEMBL2011465)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-43(58)50-36(24-30-14-8-7-9-15-30)44(59)52(4)29(3)41(56)49-37(25-31-19-21-33(55)22-20-31)45(60)54(6)39(26-32-27-48-35-17-11-10-16-34(32)35)46(61)53(5)38(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,58)(H,51,57)/t29-,36-,37-,38-,39+,40-/m0/s1 | Reactome pathway
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| n/a | n/a | 196 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50379002
(CHEMBL2011467)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C47H62N8O7/c1-29(2)41-47(62)55(7)39(26-31-15-9-8-10-16-31)45(60)52(4)30(3)42(57)50-37(25-32-20-22-34(56)23-21-32)44(59)54(6)40(27-33-28-49-36-18-12-11-17-35(33)36)46(61)53(5)38(43(58)51-41)19-13-14-24-48/h8-12,15-18,20-23,28-30,37-41,49,56H,13-14,19,24-27,48H2,1-7H3,(H,50,57)(H,51,58)/t30-,37-,38-,39-,40+,41-/m0/s1 | Reactome pathway
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PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50379001
(CHEMBL2011462)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(23-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-37(24-30-18-20-32(54)21-19-30)45(60)53(5)38(25-31-26-47-34-16-10-9-15-33(31)34)42(57)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,57)(H,49,55)(H,50,58)(H,51,56)/t28-,35-,36-,37-,38+,39-/m0/s1 | Reactome pathway
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| n/a | n/a | 205 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50378999
(CHEMBL2011464)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)48-35(23-30-18-20-32(54)21-19-30)41(56)49-37(25-31-26-47-34-16-10-9-15-33(31)34)45(60)53(5)38(42(57)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,55)(H,49,56)(H,50,58)(H,51,57)/t28-,35-,36-,37+,38-,39-/m0/s1 | Reactome pathway
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| n/a | n/a | 247 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 5
(Homo sapiens (Human)) | BDBM50379002
(CHEMBL2011467)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C47H62N8O7/c1-29(2)41-47(62)55(7)39(26-31-15-9-8-10-16-31)45(60)52(4)30(3)42(57)50-37(25-32-20-22-34(56)23-21-32)44(59)54(6)40(27-33-28-49-36-18-12-11-17-35(33)36)46(61)53(5)38(43(58)51-41)19-13-14-24-48/h8-12,15-18,20-23,28-30,37-41,49,56H,13-14,19,24-27,48H2,1-7H3,(H,50,57)(H,51,58)/t30-,37-,38-,39-,40+,41-/m0/s1 | Reactome pathway
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| n/a | n/a | 263 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst5 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50378999
(CHEMBL2011464)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)48-35(23-30-18-20-32(54)21-19-30)41(56)49-37(25-31-26-47-34-16-10-9-15-33(31)34)45(60)53(5)38(42(57)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,55)(H,49,56)(H,50,58)(H,51,57)/t28-,35-,36-,37+,38-,39-/m0/s1 | Reactome pathway
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| n/a | n/a | 308 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst3 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50379004
(CHEMBL2011466)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)49-36(24-31-19-21-33(55)22-20-31)42(57)50-37(26-32-27-48-35-17-11-10-16-34(32)35)44(59)53(5)38(43(58)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,57)(H,51,58)/t29-,36-,37+,38-,39-,40-/m0/s1 | PDB
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| n/a | n/a | 373 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Integrin alpha-V/beta-3
(Homo sapiens (Human)) | BDBM50225992
(CHEMBL237901 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7](-[#6])-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C30H45N9O8/c1-17(2)12-20-27(45)35-15-23(40)36-19(10-7-11-33-30(31)32)26(44)34-16-24(41)37-21(14-25(42)43)29(47)39(3)22(28(46)38-20)13-18-8-5-4-6-9-18/h4-6,8-9,17,19-22H,7,10-16H2,1-3H3,(H,34,44)(H,35,45)(H,36,40)(H,37,41)(H,38,46)(H,42,43)(H4,31,32,33)/t19-,20-,21-,22+/m0/s1 | PDB
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| n/a | n/a | 490 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alphavbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50225993
(CHEMBL394389 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7](-[#6])-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C30H45N9O8/c1-17(2)12-22-28(46)35-16-23(40)36-19(10-7-11-33-30(31)32)26(44)34-15-24(41)37-20(14-25(42)43)27(45)38-21(29(47)39(22)3)13-18-8-5-4-6-9-18/h4-6,8-9,17,19-22H,7,10-16H2,1-3H3,(H,34,44)(H,35,46)(H,36,40)(H,37,41)(H,38,45)(H,42,43)(H4,31,32,33)/t19-,20-,21+,22-/m0/s1 | PDB
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PubMed
| n/a | n/a | 560 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha2bbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Integrin alpha-IIb/beta-3
(Homo sapiens (Human)) | BDBM50225990
(CHEMBL236213 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7](-[#6])-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7](-[#6])-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C31H47N9O8/c1-18(2)13-22-28(46)36-17-24(41)37-20(11-8-12-34-31(32)33)27(45)35-16-25(42)38-21(15-26(43)44)29(47)40(4)23(30(48)39(22)3)14-19-9-6-5-7-10-19/h5-7,9-10,18,20-23H,8,11-17H2,1-4H3,(H,35,45)(H,36,46)(H,37,41)(H,38,42)(H,43,44)(H4,32,33,34)/t20-,21-,22-,23+/m0/s1 | PDB
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PubMed
| n/a | n/a | 620 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha2bbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Integrin alpha-5/beta-1
(Homo sapiens (Human)) | BDBM50225988
(CHEMBL235999 | c(-GRGDfL-))Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C29H43N9O8/c1-16(2)11-19-26(44)34-14-22(39)35-18(9-6-10-32-29(30)31)25(43)33-15-23(40)36-21(13-24(41)42)28(46)38-20(27(45)37-19)12-17-7-4-3-5-8-17/h3-5,7-8,16,18-21H,6,9-15H2,1-2H3,(H,33,43)(H,34,44)(H,35,39)(H,36,40)(H,37,45)(H,38,46)(H,41,42)(H4,30,31,32)/t18-,19-,20+,21-/m0/s1 | PDB
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PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alpha5beta1 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Integrin alpha-V/beta-3
(Homo sapiens (Human)) | BDBM50225987
(CHEMBL237056 | [(2S,5R,8S,14S)-5-benzyl-14-(3-guan...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7](-[#6])-[#6](=O)-[#6]-[#7]-[#6]-1=O Show InChI InChI=1S/C30H45N9O8/c1-17(2)12-19-26(44)35-16-24(41)39(3)22(10-7-11-33-30(31)32)29(47)34-15-23(40)36-21(14-25(42)43)28(46)38-20(27(45)37-19)13-18-8-5-4-6-9-18/h4-6,8-9,17,19-22H,7,10-16H2,1-3H3,(H,34,47)(H,35,44)(H,36,40)(H,37,45)(H,38,46)(H,42,43)(H4,31,32,33)/t19-,20+,21-,22-/m0/s1 | PDB
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antibodypedia
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 770 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universität München
Curated by ChEMBL
| Assay Description
Binding affinity to integrin alphavbeta3 receptor by solid phase binding assay |
J Med Chem 50: 5878-81 (2007)
Article DOI: 10.1021/jm701044r
BindingDB Entry DOI: 10.7270/Q2BZ65S1 |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50378998
(CHEMBL2011465)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-43(58)50-36(24-30-14-8-7-9-15-30)44(59)52(4)29(3)41(56)49-37(25-31-19-21-33(55)22-20-31)45(60)54(6)39(26-32-27-48-35-17-11-10-16-34(32)35)46(61)53(5)38(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,58)(H,51,57)/t29-,36-,37-,38-,39+,40-/m0/s1 | PDB
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| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50379002
(CHEMBL2011467)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C47H62N8O7/c1-29(2)41-47(62)55(7)39(26-31-15-9-8-10-16-31)45(60)52(4)30(3)42(57)50-37(25-32-20-22-34(56)23-21-32)44(59)54(6)40(27-33-28-49-36-18-12-11-17-35(33)36)46(61)53(5)38(43(58)51-41)19-13-14-24-48/h8-12,15-18,20-23,28-30,37-41,49,56H,13-14,19,24-27,48H2,1-7H3,(H,50,57)(H,51,58)/t30-,37-,38-,39-,40+,41-/m0/s1 | PDB
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| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50379003
(CHEMBL2011461)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)50-37(24-31-19-21-33(55)22-20-31)44(59)53(5)38(26-32-27-48-35-17-11-10-16-34(32)35)43(58)49-36(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,58)(H,50,56)(H,51,57)/t29-,36-,37-,38+,39-,40-/m0/s1 | PDB
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| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50378999
(CHEMBL2011464)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)48-35(23-30-18-20-32(54)21-19-30)41(56)49-37(25-31-26-47-34-16-10-9-15-33(31)34)45(60)53(5)38(42(57)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,55)(H,49,56)(H,50,58)(H,51,57)/t28-,35-,36-,37+,38-,39-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50379000
(CHEMBL2011463)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-45(60)53(5)38(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-36(23-30-18-20-32(54)21-19-30)42(57)50-37(25-31-26-47-34-16-10-9-15-33(31)34)43(58)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,58)(H,49,55)(H,50,57)(H,51,56)/t28-,35-,36-,37+,38-,39-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50379001
(CHEMBL2011462)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(23-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-37(24-30-18-20-32(54)21-19-30)45(60)53(5)38(25-31-26-47-34-16-10-9-15-33(31)34)42(57)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,57)(H,49,55)(H,50,58)(H,51,56)/t28-,35-,36-,37-,38+,39-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 4
(Homo sapiens (Human)) | BDBM50051568
((3S,6S,9S,12R,15S,18S)-9-(4-Amino-butyl)-3-benzyl-...)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O Show InChI InChI=1S/C44H56N8O7/c1-26(2)38-43(58)50-37(23-28-12-6-5-7-13-28)44(59)52(4)27(3)39(54)48-35(22-29-17-19-31(53)20-18-29)41(56)49-36(24-30-25-46-33-15-9-8-14-32(30)33)42(57)47-34(40(55)51-38)16-10-11-21-45/h5-9,12-15,17-20,25-27,34-38,46,53H,10-11,16,21-24,45H2,1-4H3,(H,47,57)(H,48,54)(H,49,56)(H,50,58)(H,51,55)/t27-,34-,35-,36+,37-,38-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst4 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 1
(Homo sapiens (Human)) | BDBM50379002
(CHEMBL2011467)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C47H62N8O7/c1-29(2)41-47(62)55(7)39(26-31-15-9-8-10-16-31)45(60)52(4)30(3)42(57)50-37(25-32-20-22-34(56)23-21-32)44(59)54(6)40(27-33-28-49-36-18-12-11-17-35(33)36)46(61)53(5)38(43(58)51-41)19-13-14-24-48/h8-12,15-18,20-23,28-30,37-41,49,56H,13-14,19,24-27,48H2,1-7H3,(H,50,57)(H,51,58)/t30-,37-,38-,39-,40+,41-/m0/s1 | KEGG
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst1 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 1
(Homo sapiens (Human)) | BDBM50379003
(CHEMBL2011461)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)50-37(24-31-19-21-33(55)22-20-31)44(59)53(5)38(26-32-27-48-35-17-11-10-16-34(32)35)43(58)49-36(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,58)(H,50,56)(H,51,57)/t29-,36-,37-,38+,39-,40-/m0/s1 | KEGG
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst1 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 1
(Homo sapiens (Human)) | BDBM50379004
(CHEMBL2011466)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-46(61)54(6)39(25-30-14-8-7-9-15-30)45(60)52(4)29(3)41(56)49-36(24-31-19-21-33(55)22-20-31)42(57)50-37(26-32-27-48-35-17-11-10-16-34(32)35)44(59)53(5)38(43(58)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,57)(H,51,58)/t29-,36-,37+,38-,39-,40-/m0/s1 | KEGG
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst1 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 1
(Homo sapiens (Human)) | BDBM50378998
(CHEMBL2011465)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C46H60N8O7/c1-28(2)40-43(58)50-36(24-30-14-8-7-9-15-30)44(59)52(4)29(3)41(56)49-37(25-31-19-21-33(55)22-20-31)45(60)54(6)39(26-32-27-48-35-17-11-10-16-34(32)35)46(61)53(5)38(42(57)51-40)18-12-13-23-47/h7-11,14-17,19-22,27-29,36-40,48,55H,12-13,18,23-26,47H2,1-6H3,(H,49,56)(H,50,58)(H,51,57)/t29-,36-,37-,38-,39+,40-/m0/s1 | KEGG
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TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst1 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 1
(Homo sapiens (Human)) | BDBM50378999
(CHEMBL2011464)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)N(C)C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-43(58)50-36(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)48-35(23-30-18-20-32(54)21-19-30)41(56)49-37(25-31-26-47-34-16-10-9-15-33(31)34)45(60)53(5)38(42(57)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,55)(H,49,56)(H,50,58)(H,51,57)/t28-,35-,36-,37+,38-,39-/m0/s1 | KEGG
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| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst1 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 1
(Homo sapiens (Human)) | BDBM50379000
(CHEMBL2011463)Show SMILES CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O |r| Show InChI InChI=1S/C45H58N8O7/c1-27(2)39-45(60)53(5)38(24-29-13-7-6-8-14-29)44(59)52(4)28(3)40(55)49-36(23-30-18-20-32(54)21-19-30)42(57)50-37(25-31-26-47-34-16-10-9-15-33(31)34)43(58)48-35(41(56)51-39)17-11-12-22-46/h6-10,13-16,18-21,26-28,35-39,47,54H,11-12,17,22-25,46H2,1-5H3,(H,48,58)(H,49,55)(H,50,57)(H,51,56)/t28-,35-,36-,37+,38-,39-/m0/s1 | KEGG
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| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Binding affinity to human sst1 by in vitro receptor autoradiography assay |
ACS Med Chem Lett 2: 509-514 (2011)
Article DOI: 10.1021/ml200032v
BindingDB Entry DOI: 10.7270/Q2HQ40WP |
More data for this
Ligand-Target Pair | |
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