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Name | Neuromedin-B receptor |
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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 | CHEMBL3952732 |
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Molecular formula | C69H100N18O18S |
IUPAC name | 2-[4-[2-[[3-[4-[[[(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]methyl]phenyl]-2,3-dioxopropyl]amino]-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid |
Molecular weight | 1501.73 |
Hydrogen bond acceptor | 25 |
Hydrogen bond donor | 16 |
XlogP | -7.7 |
Synonyms | N/A |
Inchi Key | IFWINQSJXWIZTR-RHYSEJEISA-N |
Inchi ID | InChI=1S/C69H100N18O18S/c1-40(2)27-51(67(103)80-49(63(71)99)17-26-106-6)81-68(104)53(29-46-32-72-39-77-46)79-56(90)34-76-69(105)61(41(3)4)83-64(100)42(5)78-66(102)52(28-45-31-74-48-10-8-7-9-47(45)48)82-65(101)50(15-16-55(70)89)73-30-43-11-13-44(14-12-43)62(98)54(88)33-75-57(91)35-84-18-20-85(36-58(92)93)22-24-87(38-60(96)97)25-23-86(21-19-84)37-59(94)95/h7-14,31-32,39-42,49-53,61,73-74H,15-30,33-38H2,1-6H3,(H2,70,89)(H2,71,99)(H,72,77)(H,75,91)(H,76,105)(H,78,102)(H,79,90)(H,80,103)(H,81,104)(H,82,101)(H,83,100)(H,92,93)(H,94,95)(H,96,97)/t42-,49-,50-,51-,52-,53-,61-/m0/s1 |
PubChem CID | 134145000 |
ChEMBL | CHEMBL3952732 |
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 | 0.2 nM | None | ChEMBL |
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