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Name | B1 bradykinin receptor |
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Species | Macaca fascicularis (Crab-eating macaque) |
Gene | BDKRB1 |
Synonym | B1R BK-1 receptor |
Disease | N/A for non-human GPCRs |
Length | 352 |
Amino acid sequence | MASWPPLQLQSSNQSQLFPQNATACDNAPEAWDLLHRVLPTFIISICSFGLLGNLFVLLVFLLPRRRLNVAEIYLANLAASDLVFVLGLPFWAENIWNQFNWPFGALLCRVINGIIKANLFISIFLVVAISQDRYCVLVHPMASRRRQRRRQARVTCVLIWVVGGLLSIPTFLLRSIQAVPDLNITACILLLPHEAWHFARIVELNILAFLLPLAAIIFFNYHILASLRGREEVSRTRCGGSKDSKTTALILTLVVAFLVCWAPYHFFAFLEFLFQVQAVRGCFWEDFIDLGLQLANFLAFTNSSLNPVIYVFAGRLFRTKVWELYKQCTPKSLAPISSSHRKEIFQLFWRN |
UniProt | Q3BCU0 |
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 | CHEMBL5155 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL490827 |
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Molecular formula | C30H27N5O2 |
IUPAC name | 1-benzyl-N-[2-[methyl-[(4-pyridin-2-ylphenyl)methyl]amino]-2-oxoethyl]benzimidazole-2-carboxamide |
Molecular weight | 489.579 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 4.3 |
Synonyms | BDBM50264630 N-(2-((4-(pyridin-2-yl)benzyl)(methyl)amino)-2-oxoethyl)-1-benzyl-1H-benzo[d]imidazole-2-carboxamide |
Inchi Key | ZYRLXRXALPXHFZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H27N5O2/c1-34(20-23-14-16-24(17-15-23)25-11-7-8-18-31-25)28(36)19-32-30(37)29-33-26-12-5-6-13-27(26)35(29)21-22-9-3-2-4-10-22/h2-18H,19-21H2,1H3,(H,32,37) |
PubChem CID | 44579967 |
ChEMBL | CHEMBL490827 |
IUPHAR | N/A |
BindingDB | 50264630 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 407.0 nM | PMID18752949 | BindingDB,ChEMBL |
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