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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Galanin receptor type 1' and Ligand = 'BDBM50273363'   
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
Galanin receptor type 1


(Homo sapiens (Human))
BDBM50273363
PNG
(CHEMBL526889)
Show SMILES CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C109H188N26O22/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-46-91(140)118-56-37-31-45-82(97(145)124-77(95(116)143)40-26-32-51-110)128-100(148)80(43-29-35-54-113)126-98(146)78(41-27-33-52-111)125-99(147)79(42-28-34-53-112)127-101(149)81(44-30-36-55-114)129-102(150)83(57-67(2)3)130-103(151)84(58-68(4)5)131-105(153)86(60-72-47-49-74(138)50-48-72)122-93(142)65-120-96(144)70(8)121-108(156)89(66-136)134-106(154)88(62-90(115)139)132-104(152)85(59-69(6)7)133-109(157)94(71(9)137)135-107(155)87(123-92(141)64-117-10)61-73-63-119-76-39-25-24-38-75(73)76/h24-25,38-39,47-50,63,67-71,77-89,94,117,119,136-138H,11-23,26-37,40-46,51-62,64-66,110-114H2,1-10H3,(H2,115,139)(H2,116,143)(H,118,140)(H,120,144)(H,121,156)(H,122,142)(H,123,141)(H,124,145)(H,125,147)(H,126,146)(H,127,149)(H,128,148)(H,129,150)(H,130,151)(H,131,153)(H,132,152)(H,133,157)(H,134,154)(H,135,155)/t70-,71+,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,94-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
42n/an/an/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Displacement of europium-labeled galanin from human GalR1 expressed in HEK293 EBNA cells


J Med Chem 51: 8038-47 (2008)


Article DOI: 10.1021/jm801088x
BindingDB Entry DOI: 10.7270/Q22B8ZXD
More data for this
Ligand-Target Pair