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BDBM85974 Gva6,Ala8,Ava14,15

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

InChI Key: InChIKey=RFFCGNNTYZZBGX-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 = 85974   
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))
BDBM85974
PNG
(Gva6,Ala8,Ava14,15)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#6]-[#16]-[#16]-[#6]-[#6](-[#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]-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7]
Show InChI InChI=1S/C48H80N16O11S2/c1-26(2)21-32-43(72)57-23-38(68)59-31(11-10-20-56-48(52)53)44(73)64-39(27(3)4)46(75)63-33(22-29-14-16-30(65)17-15-29)42(71)54-18-8-6-12-36(66)60-34(40(49)69)24-76-77-25-35(45(74)58-28(5)41(70)62-32)61-37(67)13-7-9-19-55-47(50)51/h14-17,26-28,31-35,39,65H,6-13,18-25H2,1-5H3,(H2,49,69)(H,54,71)(H,57,72)(H,58,74)(H,59,68)(H,60,66)(H,61,67)(H,62,70)(H,63,75)(H,64,73)(H4,50,51,55)(H4,52,53,56)
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PC cid
PC sid
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Similars

Article
PubMed
33n/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))
BDBM85974
PNG
(Gva6,Ala8,Ava14,15)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#6]-[#16]-[#16]-[#6]-[#6](-[#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]-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7]
Show InChI InChI=1S/C48H80N16O11S2/c1-26(2)21-32-43(72)57-23-38(68)59-31(11-10-20-56-48(52)53)44(73)64-39(27(3)4)46(75)63-33(22-29-14-16-30(65)17-15-29)42(71)54-18-8-6-12-36(66)60-34(40(49)69)24-76-77-25-35(45(74)58-28(5)41(70)62-32)61-37(67)13-7-9-19-55-47(50)51/h14-17,26-28,31-35,39,65H,6-13,18-25H2,1-5H3,(H2,49,69)(H,54,71)(H,57,72)(H,58,74)(H,59,68)(H,60,66)(H,61,67)(H,62,70)(H,63,75)(H,64,73)(H4,50,51,55)(H4,52,53,56)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
83n/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