Found 3 hits for monomerid = 50427693 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Melanocortin receptor 1
(Mus musculus) | BDBM50427693
(CHEMBL2323796)Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N2C[C@H](CCCN=C(N)N)NC(=O)[C@@H](CSCC2=O)NC(=O)[C@@H](Cc2ccc(cc2)-c2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1 |r,wU:96.103,82.88,5.5,63.68,37.38,13.13,wD:111.120,73.116,78.100,46.49,26.28,1.0,(24.22,-12.49,;25.56,-13.25,;26.88,-12.48,;28.22,-13.24,;28.23,-14.78,;29.55,-12.46,;30.89,-13.23,;30.89,-14.77,;32.23,-15.53,;29.56,-15.54,;29.55,-10.93,;30.88,-10.15,;32.21,-10.92,;30.9,-8.59,;32.22,-7.83,;33.51,-8.68,;34.95,-8.15,;35.9,-9.36,;35.04,-10.64,;35.42,-12.12,;34.33,-13.19,;32.85,-12.78,;32.48,-11.3,;33.56,-10.22,;29.55,-7.83,;29.56,-6.3,;28.22,-5.53,;29.56,-4.77,;30.9,-5.54,;32.22,-4.78,;33.56,-5.55,;34.89,-4.79,;36.23,-5.56,;34.9,-3.24,;28.23,-4.01,;26.91,-3.23,;26.92,-1.7,;25.56,-3.99,;25.57,-5.53,;26.9,-6.29,;26.9,-7.84,;28.24,-8.61,;28.24,-10.15,;24.25,-3.23,;22.91,-3.99,;21.55,-3.2,;22.91,-5.53,;21.57,-6.3,;20.22,-5.51,;18.87,-6.3,;17.51,-5.52,;17.5,-3.94,;18.86,-3.16,;20.23,-3.95,;16.14,-3.15,;16.15,-1.58,;14.79,-.79,;13.43,-1.57,;13.43,-3.15,;14.79,-3.93,;24.24,-6.3,;18.93,-7.89,;20.2,-8.65,;17.54,-8.66,;16.19,-7.88,;14.62,-7.92,;13.72,-9.21,;12.22,-8.76,;12.18,-7.19,;13.66,-6.67,;17.55,-10.2,;16.21,-10.98,;14.88,-10.21,;16.22,-12.52,;17.56,-13.28,;17.56,-14.82,;18.89,-15.59,;18.9,-17.13,;20.24,-17.89,;21.57,-17.11,;22.91,-17.88,;22.91,-19.42,;24.23,-17.1,;25.57,-17.87,;25.58,-19.41,;24.25,-20.18,;24.25,-21.72,;25.59,-22.48,;26.92,-21.7,;26.91,-20.17,;24.23,-15.56,;25.56,-14.79,;26.89,-15.56,;20.25,-19.43,;21.58,-20.2,;18.91,-20.2,;18.92,-21.74,;20.26,-22.51,;20.27,-24.05,;18.93,-24.82,;18.94,-26.36,;20.27,-27.12,;20.28,-28.66,;21.61,-26.34,;21.6,-24.81,;17.59,-22.52,;17.6,-24.06,;16.25,-21.75,;14.89,-13.29,;14.9,-14.83,;16.23,-15.59,;13.56,-15.6,;12.23,-14.84,;13.57,-17.14,;12.24,-17.92,;10.9,-17.16,;9.57,-17.93,;9.58,-19.47,;8.24,-20.24,;10.91,-20.24,;12.25,-19.46,)| Show InChI InChI=1S/C83H98N20O15S3/c1-46-73(109)96-62(33-47-11-4-2-5-12-47)76(112)102-68(80(116)95-61(72(86)108)32-50-22-28-57(105)29-23-50)43-121-120-42-67(100-74(110)59(84)31-48-20-26-56(104)27-21-48)81(117)98-64(36-55-39-89-45-92-55)78(114)97-63(34-49-18-24-52(25-19-49)51-13-6-3-7-14-51)77(113)101-66-41-119-44-71(107)103(40-54(94-79(66)115)15-10-30-90-83(87)88)69(35-53-38-91-60-17-9-8-16-58(53)60)82(118)99-65(37-70(85)106)75(111)93-46/h2-9,11-14,16-29,38-39,45-46,54,59,61-69,91,104-105H,10,15,30-37,40-44,84H2,1H3,(H2,85,106)(H2,86,108)(H,89,92)(H,93,111)(H,94,115)(H,95,116)(H,96,109)(H,97,114)(H,98,117)(H,99,118)(H,100,110)(H,101,113)(H,102,112)(H4,87,88,90)/t46-,54-,59-,61-,62-,63+,64-,65-,66+,67-,68-,69-/m0/s1 | KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.10 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonist activity at mouse MC1 receptor expressed in HEK293 cells after 6 hrs by cAMP-based beta-galactosidase reporter gene assay |
J Med Chem 56: 2747-63 (2013)
Article DOI: 10.1021/jm301253y
BindingDB Entry DOI: 10.7270/Q2NS0W8S |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 4
(Mus musculus) | BDBM50427693
(CHEMBL2323796)Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N2C[C@H](CCCN=C(N)N)NC(=O)[C@@H](CSCC2=O)NC(=O)[C@@H](Cc2ccc(cc2)-c2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1 |r,wU:96.103,82.88,5.5,63.68,37.38,13.13,wD:111.120,73.116,78.100,46.49,26.28,1.0,(24.22,-12.49,;25.56,-13.25,;26.88,-12.48,;28.22,-13.24,;28.23,-14.78,;29.55,-12.46,;30.89,-13.23,;30.89,-14.77,;32.23,-15.53,;29.56,-15.54,;29.55,-10.93,;30.88,-10.15,;32.21,-10.92,;30.9,-8.59,;32.22,-7.83,;33.51,-8.68,;34.95,-8.15,;35.9,-9.36,;35.04,-10.64,;35.42,-12.12,;34.33,-13.19,;32.85,-12.78,;32.48,-11.3,;33.56,-10.22,;29.55,-7.83,;29.56,-6.3,;28.22,-5.53,;29.56,-4.77,;30.9,-5.54,;32.22,-4.78,;33.56,-5.55,;34.89,-4.79,;36.23,-5.56,;34.9,-3.24,;28.23,-4.01,;26.91,-3.23,;26.92,-1.7,;25.56,-3.99,;25.57,-5.53,;26.9,-6.29,;26.9,-7.84,;28.24,-8.61,;28.24,-10.15,;24.25,-3.23,;22.91,-3.99,;21.55,-3.2,;22.91,-5.53,;21.57,-6.3,;20.22,-5.51,;18.87,-6.3,;17.51,-5.52,;17.5,-3.94,;18.86,-3.16,;20.23,-3.95,;16.14,-3.15,;16.15,-1.58,;14.79,-.79,;13.43,-1.57,;13.43,-3.15,;14.79,-3.93,;24.24,-6.3,;18.93,-7.89,;20.2,-8.65,;17.54,-8.66,;16.19,-7.88,;14.62,-7.92,;13.72,-9.21,;12.22,-8.76,;12.18,-7.19,;13.66,-6.67,;17.55,-10.2,;16.21,-10.98,;14.88,-10.21,;16.22,-12.52,;17.56,-13.28,;17.56,-14.82,;18.89,-15.59,;18.9,-17.13,;20.24,-17.89,;21.57,-17.11,;22.91,-17.88,;22.91,-19.42,;24.23,-17.1,;25.57,-17.87,;25.58,-19.41,;24.25,-20.18,;24.25,-21.72,;25.59,-22.48,;26.92,-21.7,;26.91,-20.17,;24.23,-15.56,;25.56,-14.79,;26.89,-15.56,;20.25,-19.43,;21.58,-20.2,;18.91,-20.2,;18.92,-21.74,;20.26,-22.51,;20.27,-24.05,;18.93,-24.82,;18.94,-26.36,;20.27,-27.12,;20.28,-28.66,;21.61,-26.34,;21.6,-24.81,;17.59,-22.52,;17.6,-24.06,;16.25,-21.75,;14.89,-13.29,;14.9,-14.83,;16.23,-15.59,;13.56,-15.6,;12.23,-14.84,;13.57,-17.14,;12.24,-17.92,;10.9,-17.16,;9.57,-17.93,;9.58,-19.47,;8.24,-20.24,;10.91,-20.24,;12.25,-19.46,)| Show InChI InChI=1S/C83H98N20O15S3/c1-46-73(109)96-62(33-47-11-4-2-5-12-47)76(112)102-68(80(116)95-61(72(86)108)32-50-22-28-57(105)29-23-50)43-121-120-42-67(100-74(110)59(84)31-48-20-26-56(104)27-21-48)81(117)98-64(36-55-39-89-45-92-55)78(114)97-63(34-49-18-24-52(25-19-49)51-13-6-3-7-14-51)77(113)101-66-41-119-44-71(107)103(40-54(94-79(66)115)15-10-30-90-83(87)88)69(35-53-38-91-60-17-9-8-16-58(53)60)82(118)99-65(37-70(85)106)75(111)93-46/h2-9,11-14,16-29,38-39,45-46,54,59,61-69,91,104-105H,10,15,30-37,40-44,84H2,1H3,(H2,85,106)(H2,86,108)(H,89,92)(H,93,111)(H,94,115)(H,95,116)(H,96,109)(H,97,114)(H,98,117)(H,99,118)(H,100,110)(H,101,113)(H,102,112)(H4,87,88,90)/t46-,54-,59-,61-,62-,63+,64-,65-,66+,67-,68-,69-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 760 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonist activity at mouse MC4 receptor expressed in HEK293 cells after 6 hrs by cAMP-based beta-galactosidase reporter gene assay |
J Med Chem 56: 2747-63 (2013)
Article DOI: 10.1021/jm301253y
BindingDB Entry DOI: 10.7270/Q2NS0W8S |
More data for this
Ligand-Target Pair | |
Melanocortin receptor 5 (MC5R)
(Mus musculus (Mouse)) | BDBM50427693
(CHEMBL2323796)Show SMILES C[C@@H]1NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N2C[C@H](CCCN=C(N)N)NC(=O)[C@@H](CSCC2=O)NC(=O)[C@@H](Cc2ccc(cc2)-c2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1 |r,wU:96.103,82.88,5.5,63.68,37.38,13.13,wD:111.120,73.116,78.100,46.49,26.28,1.0,(24.22,-12.49,;25.56,-13.25,;26.88,-12.48,;28.22,-13.24,;28.23,-14.78,;29.55,-12.46,;30.89,-13.23,;30.89,-14.77,;32.23,-15.53,;29.56,-15.54,;29.55,-10.93,;30.88,-10.15,;32.21,-10.92,;30.9,-8.59,;32.22,-7.83,;33.51,-8.68,;34.95,-8.15,;35.9,-9.36,;35.04,-10.64,;35.42,-12.12,;34.33,-13.19,;32.85,-12.78,;32.48,-11.3,;33.56,-10.22,;29.55,-7.83,;29.56,-6.3,;28.22,-5.53,;29.56,-4.77,;30.9,-5.54,;32.22,-4.78,;33.56,-5.55,;34.89,-4.79,;36.23,-5.56,;34.9,-3.24,;28.23,-4.01,;26.91,-3.23,;26.92,-1.7,;25.56,-3.99,;25.57,-5.53,;26.9,-6.29,;26.9,-7.84,;28.24,-8.61,;28.24,-10.15,;24.25,-3.23,;22.91,-3.99,;21.55,-3.2,;22.91,-5.53,;21.57,-6.3,;20.22,-5.51,;18.87,-6.3,;17.51,-5.52,;17.5,-3.94,;18.86,-3.16,;20.23,-3.95,;16.14,-3.15,;16.15,-1.58,;14.79,-.79,;13.43,-1.57,;13.43,-3.15,;14.79,-3.93,;24.24,-6.3,;18.93,-7.89,;20.2,-8.65,;17.54,-8.66,;16.19,-7.88,;14.62,-7.92,;13.72,-9.21,;12.22,-8.76,;12.18,-7.19,;13.66,-6.67,;17.55,-10.2,;16.21,-10.98,;14.88,-10.21,;16.22,-12.52,;17.56,-13.28,;17.56,-14.82,;18.89,-15.59,;18.9,-17.13,;20.24,-17.89,;21.57,-17.11,;22.91,-17.88,;22.91,-19.42,;24.23,-17.1,;25.57,-17.87,;25.58,-19.41,;24.25,-20.18,;24.25,-21.72,;25.59,-22.48,;26.92,-21.7,;26.91,-20.17,;24.23,-15.56,;25.56,-14.79,;26.89,-15.56,;20.25,-19.43,;21.58,-20.2,;18.91,-20.2,;18.92,-21.74,;20.26,-22.51,;20.27,-24.05,;18.93,-24.82,;18.94,-26.36,;20.27,-27.12,;20.28,-28.66,;21.61,-26.34,;21.6,-24.81,;17.59,-22.52,;17.6,-24.06,;16.25,-21.75,;14.89,-13.29,;14.9,-14.83,;16.23,-15.59,;13.56,-15.6,;12.23,-14.84,;13.57,-17.14,;12.24,-17.92,;10.9,-17.16,;9.57,-17.93,;9.58,-19.47,;8.24,-20.24,;10.91,-20.24,;12.25,-19.46,)| Show InChI InChI=1S/C83H98N20O15S3/c1-46-73(109)96-62(33-47-11-4-2-5-12-47)76(112)102-68(80(116)95-61(72(86)108)32-50-22-28-57(105)29-23-50)43-121-120-42-67(100-74(110)59(84)31-48-20-26-56(104)27-21-48)81(117)98-64(36-55-39-89-45-92-55)78(114)97-63(34-49-18-24-52(25-19-49)51-13-6-3-7-14-51)77(113)101-66-41-119-44-71(107)103(40-54(94-79(66)115)15-10-30-90-83(87)88)69(35-53-38-91-60-17-9-8-16-58(53)60)82(118)99-65(37-70(85)106)75(111)93-46/h2-9,11-14,16-29,38-39,45-46,54,59,61-69,91,104-105H,10,15,30-37,40-44,84H2,1H3,(H2,85,106)(H2,86,108)(H,89,92)(H,93,111)(H,94,115)(H,95,116)(H,96,109)(H,97,114)(H,98,117)(H,99,118)(H,100,110)(H,101,113)(H,102,112)(H4,87,88,90)/t46-,54-,59-,61-,62-,63+,64-,65-,66+,67-,68-,69-/m0/s1 | UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 87 | n/a | n/a | n/a | n/a |
University of Florida
Curated by ChEMBL
| Assay Description
Agonist activity at mouse MC5 receptor expressed in HEK293 cells after 6 hrs by cAMP-based beta-galactosidase reporter gene assay |
J Med Chem 56: 2747-63 (2013)
Article DOI: 10.1021/jm301253y
BindingDB Entry DOI: 10.7270/Q2NS0W8S |
More data for this
Ligand-Target Pair | |
Search and Browse
