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Name | Neuromedin-B receptor |
---|---|
Species | Rattus norvegicus (Rat) |
Gene | Nmbr |
Synonym | BB1 BB1 receptor neuromedin B receptor neuromedin-B-preferring bombesin receptor NMB-R |
Disease | N/A for non-human GPCRs |
Length | 390 |
Amino acid sequence | MPPRSLPNLSLPTEASESELEPEVWENDFLPDSDGTTAELVIRCVIPSLYLIIISVGLLGNIMLVKIFLTNSTMRSVPNIFISNLAAGDLLLLLTCVPVDASRYFFDEWVFGKLGCKLIPAIQLTSVGVSVFTLTALSADRYRAIVNPMDMQTSGVVLWTSLKAVGIWVVSVLLAVPEAVFSEVARIGSSDNSSFTACIPYPQTDELHPKIHSVLIFLVYFLIPLVIISIYYYHIAKTLIRSAHNLPGEYNEHTKKQMETRKRLAKIVLVFVGCFVFCWFPNHILYLYRSFNYKEIDPSLGHMIVTLVARVLSFSNSCVNPFALYLLSESFRKHFNSQLCCGQKSYPERSTSYLLSSSAVRMTSLKSNAKNVVTNSVLLNGHSTKQEIAL |
UniProt | P24053 |
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 | CHEMBL4440 |
IUPHAR | 38 |
DrugBank | N/A |
Name | CHEMBL3967904 |
---|---|
Molecular formula | C79H117N25O21S |
IUPAC name | (4S)-5-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-4-amino-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-5-oxo-4-[[(2R)-pyrrolidine-2-carbonyl]amino]pentanoic acid |
Molecular weight | 1785.02 |
Hydrogen bond acceptor | 25 |
Hydrogen bond donor | 26 |
XlogP | -6.9 |
Synonyms | N/A |
Inchi Key | HKVUCAZMMVHJQS-RAFUSTBSSA-N |
Inchi ID | InChI=1S/C79H117N25O21S/c1-39(2)29-54(75(122)96-48(66(83)113)25-28-126-6)101-76(123)57(32-44-35-86-38-92-44)94-63(110)37-91-78(125)65(40(3)4)104-67(114)41(5)93-74(121)56(31-43-34-89-47-12-8-7-11-46(43)47)103-73(120)52(20-23-60(81)107)100-77(124)58(33-61(82)108)95-62(109)36-90-68(115)55(30-42-15-17-45(105)18-16-42)102-70(117)50(14-10-27-88-79(84)85)97-71(118)51(19-22-59(80)106)99-72(119)53(21-24-64(111)112)98-69(116)49-13-9-26-87-49/h7-8,11-12,15-18,34-35,38-41,48-58,65,87,89,105H,9-10,13-14,19-33,36-37H2,1-6H3,(H2,80,106)(H2,81,107)(H2,82,108)(H2,83,113)(H,86,92)(H,90,115)(H,91,125)(H,93,121)(H,94,110)(H,95,109)(H,96,122)(H,97,118)(H,98,116)(H,99,119)(H,100,124)(H,101,123)(H,102,117)(H,103,120)(H,104,114)(H,111,112)(H4,84,85,88)/t41-,48-,49+,50-,51-,52-,53-,54-,55-,56-,57-,58-,65-/m0/s1 |
PubChem CID | 134150032 |
ChEMBL | CHEMBL3967904 |
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 |
---|---|---|---|
IC50 | 3.36 nM | None | ChEMBL |
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