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BDBM85973 Gpr6,Ava14,15

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

InChI Key: InChIKey=MDQIOIOYTLLRBX-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 = 85973   
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))
BDBM85973
PNG
(Gpr6,Ava14,15)
Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#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](=O)-[#6](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6](-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O
Show InChI InChI=1S/C51H85N17O12S3/c1-27(2)22-35-44(75)60-24-40(72)62-32(10-9-19-58-50(53)54)47(78)68-41(28(3)4)49(80)66-36(23-30-12-14-31(70)15-13-30)43(74)57-18-8-7-11-39(71)63-37(42(52)73)25-82-83-26-38(48(79)64-34(17-21-81-6)46(77)65-35)67-45(76)33(61-29(5)69)16-20-59-51(55)56/h12-15,27-28,32-38,41,70H,7-11,16-26H2,1-6H3,(H2,52,73)(H,57,74)(H,60,75)(H,61,69)(H,62,72)(H,63,71)(H,64,79)(H,65,77)(H,66,80)(H,67,76)(H,68,78)(H4,53,54,58)(H4,55,56,59)
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PC cid
PC sid
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Similars

Article
PubMed
43n/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))
BDBM85973
PNG
(Gpr6,Ava14,15)
Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#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](=O)-[#6](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6](-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O
Show InChI InChI=1S/C51H85N17O12S3/c1-27(2)22-35-44(75)60-24-40(72)62-32(10-9-19-58-50(53)54)47(78)68-41(28(3)4)49(80)66-36(23-30-12-14-31(70)15-13-30)43(74)57-18-8-7-11-39(71)63-37(42(52)73)25-82-83-26-38(48(79)64-34(17-21-81-6)46(77)65-35)67-45(76)33(61-29(5)69)16-20-59-51(55)56/h12-15,27-28,32-38,41,70H,7-11,16-26H2,1-6H3,(H2,52,73)(H,57,74)(H,60,75)(H,61,69)(H,62,72)(H,63,71)(H,64,79)(H,65,77)(H,66,80)(H,67,76)(H,68,78)(H4,53,54,58)(H4,55,56,59)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
43n/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