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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 | CHEMBL489389 |
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Molecular formula | C28H26N6O2 |
IUPAC name | 1-benzyl-N-[2-[(4-imidazol-1-ylphenyl)methyl-methylamino]-2-oxoethyl]benzimidazole-2-carboxamide |
Molecular weight | 478.556 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 3.4 |
Synonyms | BDBM50264591 N-(2-((4-(1H-imidazol-1-yl)benzyl)(methyl)amino)-2-oxoethyl)-1-benzyl-1H-benzo[d]imidazole-2-carboxamide |
Inchi Key | DEDFYZJNHSWMDS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H26N6O2/c1-32(18-22-11-13-23(14-12-22)33-16-15-29-20-33)26(35)17-30-28(36)27-31-24-9-5-6-10-25(24)34(27)19-21-7-3-2-4-8-21/h2-16,20H,17-19H2,1H3,(H,30,36) |
PubChem CID | 44579945 |
ChEMBL | CHEMBL489389 |
IUPHAR | N/A |
BindingDB | 50264591 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 626.0 nM | PMID18752949 | BindingDB,ChEMBL |
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