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BDBM85946 D-Arg6,Ava9,10,Ava14,15

SMILES: [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#7])-[#6]-[#16]-[#16]-[#6]-[#7](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6](-[#6])=O

InChI Key: InChIKey=PHIMHWDSZBIYKR-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 85946   
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
GPR145


(Homo sapiens (Human))
BDBM85946
PNG
(D-Arg6,Ava9,10,Ava14,15)
Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#7])-[#6]-[#16]-[#16]-[#6]-[#7](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6](-[#6])=O
Show InChI InChI=1S/C48H81N17O11S3/c1-28(2)39-45(75)61-36(25-30-15-17-31(67)18-16-30)42(72)55-21-8-6-14-38(69)64-65(48(76)62-34(43(73)58-29(3)66)12-10-23-57-47(52)53)27-79-78-26-32(49)40(70)60-35(19-24-77-4)41(71)54-20-7-5-13-37(68)59-33(44(74)63-39)11-9-22-56-46(50)51/h15-18,28,32-36,39,67H,5-14,19-27,49H2,1-4H3,(H,54,71)(H,55,72)(H,59,68)(H,60,70)(H,61,75)(H,62,76)(H,63,74)(H,64,69)(H4,50,51,56)(H4,52,53,57)(H,58,66,73)
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UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
45n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by PDSP Ki Database




Biochemistry 41: 6383-90 (2002)


Article DOI: 10.1021/bi0200514
BindingDB Entry DOI: 10.7270/Q23N21ZT
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (Human))
BDBM85946
PNG
(D-Arg6,Ava9,10,Ava14,15)
Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#7])-[#6]-[#16]-[#16]-[#6]-[#7](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6](-[#6])=O
Show InChI InChI=1S/C48H81N17O11S3/c1-28(2)39-45(75)61-36(25-30-15-17-31(67)18-16-30)42(72)55-21-8-6-14-38(69)64-65(48(76)62-34(43(73)58-29(3)66)12-10-23-57-47(52)53)27-79-78-26-32(49)40(70)60-35(19-24-77-4)41(71)54-20-7-5-13-37(68)59-33(44(74)63-39)11-9-22-56-46(50)51/h15-18,28,32-36,39,67H,5-14,19-27,49H2,1-4H3,(H,54,71)(H,55,72)(H,59,68)(H,60,70)(H,61,75)(H,62,76)(H,63,74)(H,64,69)(H4,50,51,56)(H4,52,53,57)(H,58,66,73)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
69n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by PDSP Ki Database




Biochemistry 41: 6383-90 (2002)


Article DOI: 10.1021/bi0200514
BindingDB Entry DOI: 10.7270/Q23N21ZT
More data for this
Ligand-Target Pair