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Name | Neuropeptide S receptor |
---|---|
Species | Mus musculus (Mouse) |
Gene | Npsr1 |
Synonym | vasopressin receptor-related receptor 1 PGR14 NPS receptor GPR154 G-protein coupled receptor PGR14 [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 371 |
Amino acid sequence | MPANLTEGSFHANQTVPMLDSSPVACTEIVTFTEALVAEEWGSFYSSFKTEQLITLWVLFVVTIVGNSVVLFSTCRRKRKSRMTFFVTQLAITDSFTGLINILTDIIWRFTGDFMAPDLVCRVVRYLQVVLLYASTYVLVSLSIDRYHAIVYPMKFLQGEKQAKVLIGIAWSLSFLFSIPTLIIFGKRTLSNGEVQCWALWPDDSYWTPYMTIVAFLVYFIPLAIISVIYGLVIRTIWMKSKTHETVISNCSDGKLCCSYNRGLISKAKIKAIKYSIVIILAFICCWSPYFLFDILDNFNVLPDTKERFYASVIIQNLPALNSAINPLIYCIFSSSICSPCKMQRSQDSRMTYRERSERHEMQILSKPEFI |
UniProt | Q8BZP8 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL5497 |
IUPHAR | 302 |
DrugBank | N/A |
Name | CHEMBL524688 |
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Molecular formula | C95H159N31O28S |
IUPAC name | (2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[2-[[(2S,3R)-2-[[2-[[(2S)-2-[[2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-[(N,N'-dimethylcarbamimidoyl)amino]pentanoyl]amino]-4-oxobutanoyl]amino]acetyl]amino]-3-methylbutanoyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]-4-methylsulfanylbutanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-oxopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]hexanoyl]amino]-3-hydroxypropanoic acid |
Molecular weight | 2215.57 |
Hydrogen bond acceptor | 35 |
Hydrogen bond donor | 36 |
XlogP | -13.2 |
Synonyms | N/A |
Inchi Key | UAAQBBSMEGGXLF-XGYQTWCRSA-N |
Inchi ID | InChI=1S/C95H159N31O28S/c1-50(2)74(124-72(135)45-108-79(139)66(43-70(101)133)121-82(142)61(31-22-39-107-95(104-6)105-7)117-87(147)64(119-78(138)56(99)47-127)41-54-23-11-9-12-24-54)90(150)109-46-73(136)125-75(52(4)130)91(151)110-44-71(134)112-63(34-40-155-8)85(145)114-58(28-16-19-36-97)81(141)115-59(29-17-20-37-98)86(146)126-76(53(5)131)92(152)122-67(48-128)89(149)120-65(42-55-25-13-10-14-26-55)88(148)118-62(32-33-69(100)132)84(144)116-60(30-21-38-106-94(102)103)80(140)111-51(3)77(137)113-57(27-15-18-35-96)83(143)123-68(49-129)93(153)154/h9-14,23-26,50-53,56-68,74-76,127-131H,15-22,27-49,96-99H2,1-8H3,(H2,100,132)(H2,101,133)(H,108,139)(H,109,150)(H,110,151)(H,111,140)(H,112,134)(H,113,137)(H,114,145)(H,115,141)(H,116,144)(H,117,147)(H,118,148)(H,119,138)(H,120,149)(H,121,142)(H,122,152)(H,123,143)(H,124,135)(H,125,136)(H,126,146)(H,153,154)(H4,102,103,106)(H2,104,105,107)/t51-,52+,53+,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,74-,75-,76-/m0/s1 |
PubChem CID | 44580134 |
ChEMBL | CHEMBL524688 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 22.39 nM | PMID18793857 | ChEMBL |
Emax | 281.0 % | PMID18793857 | ChEMBL |
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