Found 18 hits Enz. Inhib. hit(s) with all data for entry = 50047711 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 |
Urotensin-2 receptor
(Homo sapiens (Human)) | BDBM50185129
(CHEMBL3822808)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccc(cc2)-c2ccccc2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C52H66N10O13S3/c1-31(2)45(52(72)73)59-50(70)43-30-77-76-29-42(57-46(66)38(54)27-44(64)65)49(69)56-41(25-32-11-5-3-6-12-32)51(71)60-62(28-34-16-20-36(21-17-34)35-13-7-4-8-14-35)78(74,75)61-39(15-9-10-24-53)47(67)55-40(48(68)58-43)26-33-18-22-37(63)23-19-33/h3-8,11-14,16-23,31,38-43,45,61,63H,9-10,15,24-30,53-54H2,1-2H3,(H,55,67)(H,56,69)(H,57,66)(H,58,68)(H,59,70)(H,60,71)(H,64,65)(H,72,73)/t38-,39-,40-,41-,42-,43-,45-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Displacement of [125I]-hU2 from human UT2 receptor expressed in CHO cells after 90 mins by gamma counter assay |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(Homo sapiens (Human)) | BDBM50185139
(CHEMBL3823939)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NN(CCCCN(C)C)S(=O)(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H67N11O13S3/c1-29(2)43(50(71)72)57-48(69)41-28-76-75-27-40(55-44(65)35(51)25-42(63)64)47(68)53-37(22-30-12-6-5-7-13-30)45(66)54-38(24-32-26-52-36-15-9-8-14-34(32)36)49(70)58-61(21-11-10-20-60(3)4)77(73,74)59-39(46(67)56-41)23-31-16-18-33(62)19-17-31/h5-9,12-19,26,29,35,37-41,43,52,59,62H,10-11,20-25,27-28,51H2,1-4H3,(H,53,68)(H,54,66)(H,55,65)(H,56,67)(H,57,69)(H,58,70)(H,63,64)(H,71,72)/t35-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Displacement of [125I]-hU2 from human UT2 receptor expressed in CHO cells after 90 mins by gamma counter assay |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(Homo sapiens (Human)) | BDBM50185136
(CHEMBL3823122)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccc3ccccc3c2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H64N10O13S3/c1-29(2)43(50(70)71)57-48(68)41-28-75-74-27-40(55-44(64)36(52)25-42(62)63)47(67)54-39(23-30-10-4-3-5-11-30)49(69)58-60(26-32-15-18-33-12-6-7-13-34(33)22-32)76(72,73)59-37(14-8-9-21-51)45(65)53-38(46(66)56-41)24-31-16-19-35(61)20-17-31/h3-7,10-13,15-20,22,29,36-41,43,59,61H,8-9,14,21,23-28,51-52H2,1-2H3,(H,53,65)(H,54,67)(H,55,64)(H,56,66)(H,57,68)(H,58,69)(H,62,63)(H,70,71)/t36-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Displacement of [125I]-hU2 from human UT2 receptor expressed in CHO cells after 90 mins by gamma counter assay |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(Homo sapiens (Human)) | BDBM50185137
(CHEMBL3823569)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NN(CCCCN)S(=O)(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C48H63N11O13S3/c1-27(2)41(48(69)70)56-46(67)39-26-74-73-25-38(54-42(63)33(50)23-40(61)62)45(66)52-35(20-28-10-4-3-5-11-28)43(64)53-36(22-30-24-51-34-13-7-6-12-32(30)34)47(68)57-59(19-9-8-18-49)75(71,72)58-37(44(65)55-39)21-29-14-16-31(60)17-15-29/h3-7,10-17,24,27,33,35-39,41,51,58,60H,8-9,18-23,25-26,49-50H2,1-2H3,(H,52,66)(H,53,64)(H,54,63)(H,55,65)(H,56,67)(H,57,68)(H,61,62)(H,69,70)/t33-,35-,36-,37-,38-,39-,41-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Displacement of [125I]-hU2 from human UT2 receptor expressed in CHO cells after 90 mins by gamma counter assay |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(Homo sapiens (Human)) | BDBM50185135
(CHEMBL3823484)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2cccc3ccccc23)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H64N10O13S3/c1-29(2)43(50(70)71)57-48(68)41-28-75-74-27-40(55-44(64)36(52)25-42(62)63)47(67)54-39(23-30-11-4-3-5-12-30)49(69)58-60(26-33-15-10-14-32-13-6-7-16-35(32)33)76(72,73)59-37(17-8-9-22-51)45(65)53-38(46(66)56-41)24-31-18-20-34(61)21-19-31/h3-7,10-16,18-21,29,36-41,43,59,61H,8-9,17,22-28,51-52H2,1-2H3,(H,53,65)(H,54,67)(H,55,64)(H,56,66)(H,57,68)(H,58,69)(H,62,63)(H,70,71)/t36-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Displacement of [125I]-hU2 from human UT2 receptor expressed in CHO cells after 90 mins by gamma counter assay |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(Homo sapiens (Human)) | BDBM50185138
(CHEMBL3822950)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccccc2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C46H62N10O13S3/c1-27(2)39(46(66)67)53-44(64)37-26-71-70-25-36(51-40(60)32(48)23-38(58)59)43(63)50-35(21-28-11-5-3-6-12-28)45(65)54-56(24-30-13-7-4-8-14-30)72(68,69)55-33(15-9-10-20-47)41(61)49-34(42(62)52-37)22-29-16-18-31(57)19-17-29/h3-8,11-14,16-19,27,32-37,39,55,57H,9-10,15,20-26,47-48H2,1-2H3,(H,49,61)(H,50,63)(H,51,60)(H,52,62)(H,53,64)(H,54,65)(H,58,59)(H,66,67)/t32-,33-,34-,35-,36-,37-,39-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Displacement of [125I]-hU2 from human UT2 receptor expressed in CHO cells after 90 mins by gamma counter assay |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185135
(CHEMBL3823484)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2cccc3ccccc23)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H64N10O13S3/c1-29(2)43(50(70)71)57-48(68)41-28-75-74-27-40(55-44(64)36(52)25-42(62)63)47(67)54-39(23-30-11-4-3-5-12-30)49(69)58-60(26-33-15-10-14-32-13-6-7-16-35(32)33)76(72,73)59-37(17-8-9-22-51)45(65)53-38(46(66)56-41)24-31-18-20-34(61)21-19-31/h3-7,10-16,18-21,29,36-41,43,59,61H,8-9,17,22-28,51-52H2,1-2H3,(H,53,65)(H,54,67)(H,55,64)(H,56,66)(H,57,68)(H,58,69)(H,62,63)(H,70,71)/t36-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 7.90 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for URP -induced aortic contractions at 10'-5M relati... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185136
(CHEMBL3823122)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccc3ccccc3c2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H64N10O13S3/c1-29(2)43(50(70)71)57-48(68)41-28-75-74-27-40(55-44(64)36(52)25-42(62)63)47(67)54-39(23-30-10-4-3-5-11-30)49(69)58-60(26-32-15-18-33-12-6-7-13-34(33)22-32)76(72,73)59-37(14-8-9-21-51)45(65)53-38(46(66)56-41)24-31-16-19-35(61)20-17-31/h3-7,10-13,15-20,22,29,36-41,43,59,61H,8-9,14,21,23-28,51-52H2,1-2H3,(H,53,65)(H,54,67)(H,55,64)(H,56,66)(H,57,68)(H,58,69)(H,62,63)(H,70,71)/t36-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 9.5 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for URP -induced aortic contractions at 10'-5M relati... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185137
(CHEMBL3823569)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NN(CCCCN)S(=O)(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C48H63N11O13S3/c1-27(2)41(48(69)70)56-46(67)39-26-74-73-25-38(54-42(63)33(50)23-40(61)62)45(66)52-35(20-28-10-4-3-5-11-28)43(64)53-36(22-30-24-51-34-13-7-6-12-32(30)34)47(68)57-59(19-9-8-18-49)75(71,72)58-37(44(65)55-39)21-29-14-16-31(60)17-15-29/h3-7,10-17,24,27,33,35-39,41,51,58,60H,8-9,18-23,25-26,49-50H2,1-2H3,(H,52,66)(H,53,64)(H,54,63)(H,55,65)(H,56,67)(H,57,68)(H,61,62)(H,69,70)/t33-,35-,36-,37-,38-,39-,41-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 9.10 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for URP -induced aortic contractions at 10'-5M relati... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185139
(CHEMBL3823939)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NN(CCCCN(C)C)S(=O)(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H67N11O13S3/c1-29(2)43(50(71)72)57-48(69)41-28-76-75-27-40(55-44(65)35(51)25-42(63)64)47(68)53-37(22-30-12-6-5-7-13-30)45(66)54-38(24-32-26-52-36-15-9-8-14-34(32)36)49(70)58-61(21-11-10-20-60(3)4)77(73,74)59-39(46(67)56-41)23-31-16-18-33(62)19-17-31/h5-9,12-19,26,29,35,37-41,43,52,59,62H,10-11,20-25,27-28,51H2,1-4H3,(H,53,68)(H,54,66)(H,55,65)(H,56,67)(H,57,69)(H,58,70)(H,63,64)(H,71,72)/t35-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 3.70 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for URP -induced aortic contractions at 10'-5M relati... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185138
(CHEMBL3822950)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccccc2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C46H62N10O13S3/c1-27(2)39(46(66)67)53-44(64)37-26-71-70-25-36(51-40(60)32(48)23-38(58)59)43(63)50-35(21-28-11-5-3-6-12-28)45(65)54-56(24-30-13-7-4-8-14-30)72(68,69)55-33(15-9-10-20-47)41(61)49-34(42(62)52-37)22-29-16-18-31(57)19-17-29/h3-8,11-14,16-19,27,32-37,39,55,57H,9-10,15,20-26,47-48H2,1-2H3,(H,49,61)(H,50,63)(H,51,60)(H,52,62)(H,53,64)(H,54,65)(H,58,59)(H,66,67)/t32-,33-,34-,35-,36-,37-,39-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 4.80 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for hU2-induced aortic contractions at 10'-5M relativ... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185138
(CHEMBL3822950)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccccc2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C46H62N10O13S3/c1-27(2)39(46(66)67)53-44(64)37-26-71-70-25-36(51-40(60)32(48)23-38(58)59)43(63)50-35(21-28-11-5-3-6-12-28)45(65)54-56(24-30-13-7-4-8-14-30)72(68,69)55-33(15-9-10-20-47)41(61)49-34(42(62)52-37)22-29-16-18-31(57)19-17-29/h3-8,11-14,16-19,27,32-37,39,55,57H,9-10,15,20-26,47-48H2,1-2H3,(H,49,61)(H,50,63)(H,51,60)(H,52,62)(H,53,64)(H,54,65)(H,58,59)(H,66,67)/t32-,33-,34-,35-,36-,37-,39-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 3.5 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for URP -induced aortic contractions at 10'-5M relati... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185135
(CHEMBL3823484)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2cccc3ccccc23)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H64N10O13S3/c1-29(2)43(50(70)71)57-48(68)41-28-75-74-27-40(55-44(64)36(52)25-42(62)63)47(67)54-39(23-30-11-4-3-5-12-30)49(69)58-60(26-33-15-10-14-32-13-6-7-16-35(32)33)76(72,73)59-37(17-8-9-22-51)45(65)53-38(46(66)56-41)24-31-18-20-34(61)21-19-31/h3-7,10-16,18-21,29,36-41,43,59,61H,8-9,17,22-28,51-52H2,1-2H3,(H,53,65)(H,54,67)(H,55,64)(H,56,66)(H,57,68)(H,58,69)(H,62,63)(H,70,71)/t36-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 5 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for hU2-induced aortic contractions at 10'-5M relativ... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185136
(CHEMBL3823122)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccc3ccccc3c2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H64N10O13S3/c1-29(2)43(50(70)71)57-48(68)41-28-75-74-27-40(55-44(64)36(52)25-42(62)63)47(67)54-39(23-30-10-4-3-5-11-30)49(69)58-60(26-32-15-18-33-12-6-7-13-34(33)22-32)76(72,73)59-37(14-8-9-21-51)45(65)53-38(46(66)56-41)24-31-16-19-35(61)20-17-31/h3-7,10-13,15-20,22,29,36-41,43,59,61H,8-9,14,21,23-28,51-52H2,1-2H3,(H,53,65)(H,54,67)(H,55,64)(H,56,66)(H,57,68)(H,58,69)(H,62,63)(H,70,71)/t36-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 15 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for hU2-induced aortic contractions at 10'-5M relativ... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185137
(CHEMBL3823569)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NN(CCCCN)S(=O)(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C48H63N11O13S3/c1-27(2)41(48(69)70)56-46(67)39-26-74-73-25-38(54-42(63)33(50)23-40(61)62)45(66)52-35(20-28-10-4-3-5-11-28)43(64)53-36(22-30-24-51-34-13-7-6-12-32(30)34)47(68)57-59(19-9-8-18-49)75(71,72)58-37(44(65)55-39)21-29-14-16-31(60)17-15-29/h3-7,10-17,24,27,33,35-39,41,51,58,60H,8-9,18-23,25-26,49-50H2,1-2H3,(H,52,66)(H,53,64)(H,54,63)(H,55,65)(H,56,67)(H,57,68)(H,61,62)(H,69,70)/t33-,35-,36-,37-,38-,39-,41-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 2.60 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for hU2-induced aortic contractions at 10'-5M relativ... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185139
(CHEMBL3823939)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NN(CCCCN(C)C)S(=O)(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C50H67N11O13S3/c1-29(2)43(50(71)72)57-48(69)41-28-76-75-27-40(55-44(65)35(51)25-42(63)64)47(68)53-37(22-30-12-6-5-7-13-30)45(66)54-38(24-32-26-52-36-15-9-8-14-34(32)36)49(70)58-61(21-11-10-20-60(3)4)77(73,74)59-39(46(67)56-41)23-31-16-18-33(62)19-17-31/h5-9,12-19,26,29,35,37-41,43,52,59,62H,10-11,20-25,27-28,51H2,1-4H3,(H,53,68)(H,54,66)(H,55,65)(H,56,67)(H,57,69)(H,58,70)(H,63,64)(H,71,72)/t35-,37-,38-,39-,40-,41-,43-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 1.60 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for hU2-induced aortic contractions at 10'-5M relativ... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185129
(CHEMBL3822808)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccc(cc2)-c2ccccc2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C52H66N10O13S3/c1-31(2)45(52(72)73)59-50(70)43-30-77-76-29-42(57-46(66)38(54)27-44(64)65)49(69)56-41(25-32-11-5-3-6-12-32)51(71)60-62(28-34-16-20-36(21-17-34)35-13-7-4-8-14-35)78(74,75)61-39(15-9-10-24-53)47(67)55-40(48(68)58-43)26-33-18-22-37(63)23-19-33/h3-8,11-14,16-23,31,38-43,45,61,63H,9-10,15,24-30,53-54H2,1-2H3,(H,55,67)(H,56,69)(H,57,66)(H,58,68)(H,59,70)(H,60,71)(H,64,65)(H,72,73)/t38-,39-,40-,41-,42-,43-,45-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 13 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for URP -induced aortic contractions at 10'-5M relati... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |
Urotensin-2 receptor
(RAT) | BDBM50185129
(CHEMBL3822808)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc2ccccc2)C(=O)NN(Cc2ccc(cc2)-c2ccccc2)S(=O)(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C52H66N10O13S3/c1-31(2)45(52(72)73)59-50(70)43-30-77-76-29-42(57-46(66)38(54)27-44(64)65)49(69)56-41(25-32-11-5-3-6-12-32)51(71)60-62(28-34-16-20-36(21-17-34)35-13-7-4-8-14-35)78(74,75)61-39(15-9-10-24-53)47(67)55-40(48(68)58-43)26-33-18-22-37(63)23-19-33/h3-8,11-14,16-23,31,38-43,45,61,63H,9-10,15,24-30,53-54H2,1-2H3,(H,55,67)(H,56,69)(H,57,66)(H,58,68)(H,59,70)(H,60,71)(H,64,65)(H,72,73)/t38-,39-,40-,41-,42-,43-,45-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 9.5 | n/a | n/a | n/a | n/a |
Universit£ de Montr£al
Curated by ChEMBL
| Assay Description Antagonist activity at UT2 receptor in Sprague-Dawley rat thoracic aorta ring assessed as pEC50 for hU2-induced aortic contractions at 10'-5M relativ... |
J Med Chem 59: 4740-52 (2016)
Article DOI: 10.1021/acs.jmedchem.6b00108 BindingDB Entry DOI: 10.7270/Q2SB47Q1 |
More data for this Ligand-Target Pair | |