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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM135754'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135754
PNG
(US10179804, Example 139 | US8846601, 139 | US94582...)
Show SMILES NCC[C@@H]1NC(=O)[C@H](CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CC1CCCCC1
Show InChI InChI=1S/C54H81N17O9/c55-23-22-40-49(77)69-41(27-32-13-3-1-4-14-32)50(78)67-39(21-12-26-63-54(59)60)48(76)70-42(29-34-31-64-36-18-8-7-17-35(34)36)51(79)66-37(46(56)74)19-9-10-24-61-44(72)30-43(52(80)68-40)71-47(75)38(20-11-25-62-53(57)58)65-45(73)28-33-15-5-2-6-16-33/h1,3-4,7-8,13-14,17-18,31,33,37-43,64H,2,5-6,9-12,15-16,19-30,55H2,(H2,56,74)(H,61,72)(H,65,73)(H,66,79)(H,67,78)(H,68,80)(H,69,77)(H,70,76)(H,71,75)(H4,57,58,62)(H4,59,60,63)/t37-,38-,39-,40-,41+,42-,43-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1n/an/an/an/an/an/a7.5n/a



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US8846601 (2014)


BindingDB Entry DOI: 10.7270/Q2SF2TWK
More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135754
PNG
(US10179804, Example 139 | US8846601, 139 | US94582...)
Show SMILES NCC[C@@H]1NC(=O)[C@H](CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CC1CCCCC1
Show InChI InChI=1S/C54H81N17O9/c55-23-22-40-49(77)69-41(27-32-13-3-1-4-14-32)50(78)67-39(21-12-26-63-54(59)60)48(76)70-42(29-34-31-64-36-18-8-7-17-35(34)36)51(79)66-37(46(56)74)19-9-10-24-61-44(72)30-43(52(80)68-40)71-47(75)38(20-11-25-62-53(57)58)65-45(73)28-33-15-5-2-6-16-33/h1,3-4,7-8,13-14,17-18,31,33,37-43,64H,2,5-6,9-12,15-16,19-30,55H2,(H2,56,74)(H,61,72)(H,65,73)(H,66,79)(H,67,78)(H,68,80)(H,69,77)(H,70,76)(H,71,75)(H4,57,58,62)(H4,59,60,63)/t37-,38-,39-,40-,41+,42-,43-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1n/an/an/an/an/an/an/an/a



Palatin Technologies, Inc.

US Patent


Assay Description
Accumulation of intracellular cAMP was examined as a measure of the ability of the peptides of the present invention to elicit a functional response ...


US Patent US10179804 (2019)

More data for this
Ligand-Target Pair
Melanocortin receptor 4


(Homo sapiens (Human))
BDBM135754
PNG
(US10179804, Example 139 | US8846601, 139 | US94582...)
Show SMILES NCC[C@@H]1NC(=O)[C@H](CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CC1CCCCC1
Show InChI InChI=1S/C54H81N17O9/c55-23-22-40-49(77)69-41(27-32-13-3-1-4-14-32)50(78)67-39(21-12-26-63-54(59)60)48(76)70-42(29-34-31-64-36-18-8-7-17-35(34)36)51(79)66-37(46(56)74)19-9-10-24-61-44(72)30-43(52(80)68-40)71-47(75)38(20-11-25-62-53(57)58)65-45(73)28-33-15-5-2-6-16-33/h1,3-4,7-8,13-14,17-18,31,33,37-43,64H,2,5-6,9-12,15-16,19-30,55H2,(H2,56,74)(H,61,72)(H,65,73)(H,66,79)(H,67,78)(H,68,80)(H,69,77)(H,70,76)(H,71,75)(H4,57,58,62)(H4,59,60,63)/t37-,38-,39-,40-,41+,42-,43-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1 -53.4n/an/an/an/an/a7.537



Palatin Technologies, Inc.

US Patent


Assay Description
A competitive inhibition binding assay is performed using membrane homogenates prepared from HEK-293 cells that express recombinant hMC4-R, hMC3-R, o...


US Patent US9458201 (2016)


BindingDB Entry DOI: 10.7270/Q2HT2N79
More data for this
Ligand-Target Pair