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9 similar compounds to monomer 50017131

Wt: 748.2
BDBM50017135
Wt: 842.6
BDBM50017153
Wt: 839.6
BDBM50017155
Wt: 806.6
BDBM50017163
Wt: 803.6
BDBM50017165
Wt: 920.5
BDBM50017156
Wt: 806.6
BDBM50017157
Wt: 920.5
BDBM50017162
Wt: 748.2
BDBM50017169

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 50017135,50017153,50017155,50017163,50017165,50017156,50017157,50017162,50017169   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017135
PNG
(CHEMBL3287328)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C36H42ClN9O7/c1-21(47)42-28(7-4-16-41-36(39)40)33(49)44-30(18-22-8-12-26(37)13-9-22)35(51)45-20-25-6-3-2-5-24(25)19-31(45)34(50)43-29(32(38)48)17-23-10-14-27(15-11-23)46(52)53/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,38,48)(H,42,47)(H,43,50)(H,44,49)(H4,39,40,41)/t28-,29+,30+,31?/m0/s1
KEGG

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n/an/an/an/a 0.210n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 1


(Mus musculus)
BDBM50017135
PNG
(CHEMBL3287328)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C36H42ClN9O7/c1-21(47)42-28(7-4-16-41-36(39)40)33(49)44-30(18-22-8-12-26(37)13-9-22)35(51)45-20-25-6-3-2-5-24(25)19-31(45)34(50)43-29(32(38)48)17-23-10-14-27(15-11-23)46(52)53/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,38,48)(H,42,47)(H,43,50)(H,44,49)(H4,39,40,41)/t28-,29+,30+,31?/m0/s1
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n/an/an/an/a 22n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin-1 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assessed as stim...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 3


(Mus musculus)
BDBM50017135
PNG
(CHEMBL3287328)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C36H42ClN9O7/c1-21(47)42-28(7-4-16-41-36(39)40)33(49)44-30(18-22-8-12-26(37)13-9-22)35(51)45-20-25-6-3-2-5-24(25)19-31(45)34(50)43-29(32(38)48)17-23-10-14-27(15-11-23)46(52)53/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,38,48)(H,42,47)(H,43,50)(H,44,49)(H4,39,40,41)/t28-,29+,30+,31?/m0/s1
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n/an/an/an/a 94n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin-3 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assessed as stim...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Mus musculus)
BDBM50017135
PNG
(CHEMBL3287328)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C36H42ClN9O7/c1-21(47)42-28(7-4-16-41-36(39)40)33(49)44-30(18-22-8-12-26(37)13-9-22)35(51)45-20-25-6-3-2-5-24(25)19-31(45)34(50)43-29(32(38)48)17-23-10-14-27(15-11-23)46(52)53/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,38,48)(H,42,47)(H,43,50)(H,44,49)(H4,39,40,41)/t28-,29+,30+,31?/m0/s1
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n/an/an/an/a 7.60n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assessed as stim...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 5 (MC5R)


(Mus musculus (Mouse))
BDBM50017135
PNG
(CHEMBL3287328)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C36H42ClN9O7/c1-21(47)42-28(7-4-16-41-36(39)40)33(49)44-30(18-22-8-12-26(37)13-9-22)35(51)45-20-25-6-3-2-5-24(25)19-31(45)34(50)43-29(32(38)48)17-23-10-14-27(15-11-23)46(52)53/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,38,48)(H,42,47)(H,43,50)(H,44,49)(H4,39,40,41)/t28-,29+,30+,31?/m0/s1
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n/an/an/an/a 1n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at mouse melanocortin-5 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assessed as stim...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017153
PNG
(CHEMBL3287330)
Show SMILES CC(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C40H39IN6O7/c1-24(48)45-22-29-8-4-2-6-27(29)20-35(45)38(50)44-34(19-25-10-14-31(41)15-11-25)40(52)46-23-30-9-5-3-7-28(30)21-36(46)39(51)43-33(37(42)49)18-26-12-16-32(17-13-26)47(53)54/h2-17,33-36H,18-23H2,1H3,(H2,42,49)(H,43,51)(H,44,50)/t33-,34-,35?,36?/m1/s1
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n/an/an/an/a 5.10n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017169
PNG
(CHEMBL3287347)
Show SMILES CC(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C36H42ClN9O7/c1-21(47)45-20-25-6-3-2-5-24(25)19-31(45)35(51)44-30(18-22-8-12-26(37)13-9-22)34(50)42-28(7-4-16-41-36(39)40)33(49)43-29(32(38)48)17-23-10-14-27(15-11-23)46(52)53/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,38,48)(H,42,50)(H,43,49)(H,44,51)(H4,39,40,41)/t28-,29+,30+,31?/m0/s1
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n/an/an/an/a 40n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017156
PNG
(CHEMBL3287334)
Show SMILES CC(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(I)cc1)C(N)=O
Show InChI InChI=1S/C36H42I2N8O5/c1-21(47)46-20-25-6-3-2-5-24(25)19-31(46)35(51)45-30(18-23-10-14-27(38)15-11-23)34(50)43-28(7-4-16-42-36(40)41)33(49)44-29(32(39)48)17-22-8-12-26(37)13-9-22/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,39,48)(H,43,50)(H,44,49)(H,45,51)(H4,40,41,42)/t28-,29-,30+,31?/m0/s1
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n/an/an/an/a 4.30n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017157
PNG
(CHEMBL3287335)
Show SMILES CC(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1Cc2ccccc2CC1C(N)=O
Show InChI InChI=1S/C37H43IN8O5/c1-22(47)45-20-26-9-4-3-8-25(26)19-32(45)35(50)44-30(17-23-12-14-28(38)15-13-23)34(49)43-29(11-6-16-42-37(40)41)36(51)46-21-27-10-5-2-7-24(27)18-31(46)33(39)48/h2-5,7-10,12-15,29-32H,6,11,16-21H2,1H3,(H2,39,48)(H,43,49)(H,44,50)(H4,40,41,42)/t29-,30+,31?,32?/m0/s1
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n/an/an/an/a 280n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017162
PNG
(CHEMBL3287340)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N[C@@H](Cc1ccc(I)cc1)C(N)=O
Show InChI InChI=1S/C36H42I2N8O5/c1-21(47)43-28(7-4-16-42-36(40)41)33(49)45-30(18-23-10-14-27(38)15-11-23)35(51)46-20-25-6-3-2-5-24(25)19-31(46)34(50)44-29(32(39)48)17-22-8-12-26(37)13-9-22/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,39,48)(H,43,47)(H,44,50)(H,45,49)(H4,40,41,42)/t28-,29-,30+,31?/m0/s1
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n/an/an/an/a 203n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017163
PNG
(CHEMBL3287341)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N1Cc2ccccc2CC1C(=O)N1Cc2ccccc2CC1C(N)=O
Show InChI InChI=1S/C37H43IN8O5/c1-22(47)43-29(11-6-16-42-37(40)41)34(49)44-30(17-23-12-14-28(38)15-13-23)35(50)46-21-27-10-5-3-8-25(27)19-32(46)36(51)45-20-26-9-4-2-7-24(26)18-31(45)33(39)48/h2-5,7-10,12-15,29-32H,6,11,16-21H2,1H3,(H2,39,48)(H,43,47)(H,44,49)(H4,40,41,42)/t29-,30+,31?,32?/m0/s1
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n/an/an/an/a 2.26E+3n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017165
PNG
(CHEMBL3287343)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1Cc2ccccc2CC1C(N)=O
Show InChI InChI=1S/C33H46IN11O5/c1-19(46)42-24(8-4-14-40-32(36)37)29(48)44-26(16-20-10-12-23(34)13-11-20)30(49)43-25(9-5-15-41-33(38)39)31(50)45-18-22-7-3-2-6-21(22)17-27(45)28(35)47/h2-3,6-7,10-13,24-27H,4-5,8-9,14-18H2,1H3,(H2,35,47)(H,42,46)(H,43,49)(H,44,48)(H4,36,37,40)(H4,38,39,41)/t24-,25-,26+,27?/m0/s1
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n/an/an/an/a 57n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM50017155
PNG
(CHEMBL3287333)
Show SMILES CC(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C36H42IN9O7/c1-21(47)45-20-25-6-3-2-5-24(25)19-31(45)35(51)44-30(18-22-8-12-26(37)13-9-22)34(50)42-28(7-4-16-41-36(39)40)33(49)43-29(32(38)48)17-23-10-14-27(15-11-23)46(52)53/h2-3,5-6,8-15,28-31H,4,7,16-20H2,1H3,(H2,38,48)(H,42,50)(H,43,49)(H,44,51)(H4,39,40,41)/t28-,29+,30+,31?/m0/s1
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n/an/an/an/a 20n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Agonist activity at wild type human melanocortin-4 receptor expressed in HEK293 cells co-transfected with CRE/beta-galactosidase reporter gene assess...


J Med Chem 57: 4615-28 (2014)

More data for this
Ligand-Target Pair