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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 | CHEMBL3939368 |
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Molecular formula | C68H108N18O17 |
IUPAC name | 2-[4-[2-[[8-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[(1-amino-1-oxohexan-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]-8-oxooctyl]amino]-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid |
Molecular weight | 1449.72 |
Hydrogen bond acceptor | 22 |
Hydrogen bond donor | 16 |
XlogP | -6.0 |
Synonyms | N/A |
Inchi Key | KSNGZXYVZAZHMA-QGOMDGJASA-N |
Inchi ID | InChI=1S/C68H108N18O17/c1-7-8-17-49(62(70)97)79-66(101)51(31-42(2)3)80-67(102)53(33-46-35-71-41-75-46)78-56(89)36-74-68(103)61(43(4)5)82-63(98)44(6)76-65(100)52(32-45-34-73-48-18-14-13-16-47(45)48)81-64(99)50(20-21-54(69)87)77-55(88)19-12-10-9-11-15-22-72-57(90)37-83-23-25-84(38-58(91)92)27-29-86(40-60(95)96)30-28-85(26-24-83)39-59(93)94/h13-14,16,18,34-35,41-44,49-53,61,73H,7-12,15,17,19-33,36-40H2,1-6H3,(H2,69,87)(H2,70,97)(H,71,75)(H,72,90)(H,74,103)(H,76,100)(H,77,88)(H,78,89)(H,79,101)(H,80,102)(H,81,99)(H,82,98)(H,91,92)(H,93,94)(H,95,96)/t44-,49?,50-,51-,52-,53-,61-/m0/s1 |
PubChem CID | 134149621 |
ChEMBL | CHEMBL3939368 |
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 | 14.0 nM | None | ChEMBL |
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