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Name | B1 bradykinin receptor |
---|---|
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 | CHEMBL490406 |
---|---|
Molecular formula | C28H30N6O2 |
IUPAC name | 1-benzyl-N-[1-oxo-1-(4-pyridin-4-ylpiperazin-1-yl)butan-2-yl]benzimidazole-2-carboxamide |
Molecular weight | 482.588 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.6 |
Synonyms | 1-benzyl-N-(1-oxo-1-(4-(pyridin-4-yl)piperazin-1-yl)butan-2-yl)-1H-benzo[d]imidazole-2-carboxamide BDBM50264299 |
Inchi Key | JBYAAIASXHWJON-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H30N6O2/c1-2-23(28(36)33-18-16-32(17-19-33)22-12-14-29-15-13-22)31-27(35)26-30-24-10-6-7-11-25(24)34(26)20-21-8-4-3-5-9-21/h3-15,23H,2,16-20H2,1H3,(H,31,35) |
PubChem CID | 44579796 |
ChEMBL | CHEMBL490406 |
IUPHAR | N/A |
BindingDB | 50264299 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | <5000.0 nM | PMID18752949 | BindingDB,ChEMBL |
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