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BDBM160248 US9040663, 94

SMILES: CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CCCNC(=O)CC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(cc2)C#N)NC(=O)[C@H](CCC(N)=O)NC1=O)C(N)=O

InChI Key: InChIKey=ZPJUVTYUNQXFHK-OFDRTADWSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 160248   
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))
BDBM160248
PNG
(US9040663, 94)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CCCNC(=O)CC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(cc2)C#N)NC(=O)[C@H](CCC(N)=O)NC1=O)C(N)=O
Show InChI InChI=1S/C50H70N18O10/c1-27(69)62-34(9-5-21-59-49(54)55)43(73)64-35-10-4-20-58-41(71)19-17-33(42(53)72)63-48(78)39(24-30-26-61-32-8-3-2-7-31(30)32)68-45(75)36(11-6-22-60-50(56)57)65-47(77)38(23-28-12-14-29(25-51)15-13-28)67-46(76)37(66-44(35)74)16-18-40(52)70/h2-3,7-8,12-15,26,33-39,61H,4-6,9-11,16-24H2,1H3,(H2,52,70)(H2,53,72)(H,58,71)(H,62,69)(H,63,78)(H,64,73)(H,65,77)(H,66,74)(H,67,76)(H,68,75)(H4,54,55,59)(H4,56,57,60)/t33-,34-,35-,36-,37-,38+,39-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

0.900 -12.8n/an/an/an/an/a7.537



AstraZeneca AB

US Patent


Assay Description
A competitive inhibition binding assay was performed for exemplified peptides according to the invention using membrane homogenates prepared from HEK...


US Patent US9040663 (2015)


BindingDB Entry DOI: 10.7270/Q29885SK
More data for this
Ligand-Target Pair