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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 | CHEMBL499993 |
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Molecular formula | C91H149N29O29S |
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)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-4-oxobutanoyl]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 | 2145.43 |
Hydrogen bond acceptor | 35 |
Hydrogen bond donor | 35 |
XlogP | -14.3 |
Synonyms | N/A |
Inchi Key | FVHAJOQSQKCRIZ-LSISIYDRSA-N |
Inchi ID | InChI=1S/C91H149N29O29S/c1-46(2)71(118-69(130)41-102-76(134)61(38-66(97)127)114-85(143)62(39-67(98)128)115-84(142)59(112-75(133)52(95)43-121)36-50-20-9-7-10-21-50)87(145)103-42-70(131)119-72(48(4)124)88(146)104-40-68(129)106-58(30-35-150-6)81(139)108-54(25-14-17-32-93)78(136)109-55(26-15-18-33-94)82(140)120-73(49(5)125)89(147)116-63(44-122)86(144)113-60(37-51-22-11-8-12-23-51)83(141)111-57(28-29-65(96)126)80(138)110-56(27-19-34-101-91(99)100)77(135)105-47(3)74(132)107-53(24-13-16-31-92)79(137)117-64(45-123)90(148)149/h7-12,20-23,46-49,52-64,71-73,121-125H,13-19,24-45,92-95H2,1-6H3,(H2,96,126)(H2,97,127)(H2,98,128)(H,102,134)(H,103,145)(H,104,146)(H,105,135)(H,106,129)(H,107,132)(H,108,139)(H,109,136)(H,110,138)(H,111,141)(H,112,133)(H,113,144)(H,114,143)(H,115,142)(H,116,147)(H,117,137)(H,118,130)(H,119,131)(H,120,140)(H,148,149)(H4,99,100,101)/t47-,48+,49+,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,71-,72-,73-/m0/s1 |
PubChem CID | 44580122 |
ChEMBL | CHEMBL499993 |
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 |
---|---|---|---|
Activity | 161.0 % | PMID18793857 | ChEMBL |
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