BindingDB logo
myBDB logout

null

SMILES: CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNC(=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)CCCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O

InChI Key: InChIKey=SMJGXOJOZWGTDJ-JUOOEUJGSA-N

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 = 50273361   
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
Galanin receptor type 1


(Homo sapiens (Human))
BDBM50273361
PNG
((S)-N-((S)-6-amino-1-((S)-6-amino-1-((S)-1-((S)-1,...)
Show SMILES CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNC(=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)CCCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C107H180N24O22/c1-10-11-12-13-14-15-16-17-18-19-20-21-23-44-89(136)114-54-35-30-42-78(97(143)121-76(94(113)140)39-27-32-51-109)123-98(144)77(40-28-33-52-110)122-99(145)79(41-29-34-53-111)124-106(152)87-43-36-55-131(87)92(139)64-117-96(142)80(56-66(2)3)125-100(146)81(57-67(4)5)126-102(148)83(59-71-46-48-73(134)49-47-71)120-91(138)63-116-95(141)69(8)118-105(151)86(65-132)129-103(149)85(61-88(112)135)127-101(147)82(58-68(6)7)128-107(153)93(70(9)133)130-104(150)84(119-90(137)45-24-22-31-50-108)60-72-62-115-75-38-26-25-37-74(72)75/h25-26,37-38,46-49,62,66-70,76-87,93,115,132-134H,10-24,27-36,39-45,50-61,63-65,108-111H2,1-9H3,(H2,112,135)(H2,113,140)(H,114,136)(H,116,141)(H,117,142)(H,118,151)(H,119,137)(H,120,138)(H,121,143)(H,122,145)(H,123,144)(H,124,152)(H,125,146)(H,126,148)(H,127,147)(H,128,153)(H,129,149)(H,130,150)/t69-,70+,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,93-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
22n/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
Galanin receptor type 2


(Homo sapiens (Human))
BDBM50273361
PNG
((S)-N-((S)-6-amino-1-((S)-6-amino-1-((S)-1-((S)-1,...)
Show SMILES CCCCCCCCCCCCCCCC(=O)NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNC(=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)CCCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C107H180N24O22/c1-10-11-12-13-14-15-16-17-18-19-20-21-23-44-89(136)114-54-35-30-42-78(97(143)121-76(94(113)140)39-27-32-51-109)123-98(144)77(40-28-33-52-110)122-99(145)79(41-29-34-53-111)124-106(152)87-43-36-55-131(87)92(139)64-117-96(142)80(56-66(2)3)125-100(146)81(57-67(4)5)126-102(148)83(59-71-46-48-73(134)49-47-71)120-91(138)63-116-95(141)69(8)118-105(151)86(65-132)129-103(149)85(61-88(112)135)127-101(147)82(58-68(6)7)128-107(153)93(70(9)133)130-104(150)84(119-90(137)45-24-22-31-50-108)60-72-62-115-75-38-26-25-37-74(72)75/h25-26,37-38,46-49,62,66-70,76-87,93,115,132-134H,10-24,27-36,39-45,50-61,63-65,108-111H2,1-9H3,(H2,112,135)(H2,113,140)(H,114,136)(H,116,141)(H,117,142)(H,118,151)(H,119,137)(H,120,138)(H,121,143)(H,122,145)(H,123,144)(H,124,152)(H,125,146)(H,126,148)(H,127,147)(H,128,153)(H,129,149)(H,130,150)/t69-,70+,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,93-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
51n/an/an/an/an/an/an/an/a



University of Utah

Curated by ChEMBL


Assay Description
Displacement of europium-labeled galanin from human GalR2 expressed in CHO-K1 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