Reaction Details | |||
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Target | C5a anaphylatoxin chemotactic receptor 1 | ||
Ligand | BDBM50077483 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_41605 (CHEMBL650558) | ||
IC50 | 2630.27±n/a nM | ||
Citation | Finch, AM; Wong, AK; Paczkowski, NJ; Wadi, SK; Craik, DJ; Fairlie, DP; Taylor, SM Low-molecular-weight peptidic and cyclic antagonists of the receptor for the complement factor C5a. J Med Chem42:1965-74 (1999) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
C5a anaphylatoxin chemotactic receptor 1 | |||
Name: | C5a anaphylatoxin chemotactic receptor 1 | ||
Synonyms: | C5AR | C5AR1 | C5AR1_HUMAN | C5R1 | C5a anaphylatoxin chemotactic receptor | C5a anaphylatoxin chemotactic receptor (C5aR) | C5a-R | CD_antigen=CD88 | ||
Type: | Enzyme | ||
Mol. Mass.: | 39347.68 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P21730 | ||
Residue: | 350 | ||
Sequence: |
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BDBM50077483 | |||
n/a | |||
Name | BDBM50077483 | ||
Synonyms: | (R)-2-[(S)-2-{(R)-2-[((R)-1-{(S)-6-Amino-2-[(S)-2-((S)-2,6-diamino-hexanoylamino)-3-phenyl-propionylamino]-hexanoyl}-pyrrolidine-2-carbonyl)-amino]-3-cyclohexyl-propionylamino}-3-(1H-indol-3-yl)-propionylamino]-5-guanidino-pentanoic acid | CHEMBL2373534 | ||
Type | Small organic molecule | ||
Emp. Form. | C47H69N11O7 | ||
Mol. Mass. | 900.1203 | ||
SMILES | CN[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@@H]1C(=O)N[C@H](CC1CCCCC1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O |wU:40.42,54.58,2.2,wD:25.27,13.13,29.30,(.4,-4.76,;1.74,-5.54,;3.07,-4.77,;3.07,-3.23,;4.4,-2.46,;5.73,-3.23,;7.06,-2.46,;7.06,-.92,;5.73,-.15,;4.4,-.92,;4.4,-5.54,;4.4,-7.08,;5.73,-4.77,;6.5,-6.1,;5.73,-7.43,;6.5,-8.76,;5.73,-10.1,;6.5,-11.44,;5.73,-12.77,;7.83,-6.87,;7.82,-8.41,;9.15,-6.1,;9.55,-4.61,;11.09,-4.53,;11.65,-5.96,;10.45,-6.94,;11.78,-7.71,;13.11,-6.94,;11.78,-9.25,;13.11,-10.03,;14.41,-9.18,;15.77,-9.88,;16.14,-11.38,;16.72,-10.26,;18.38,-9.53,;18.03,-8.04,;17.38,-9.21,;13.87,-11.35,;15.41,-11.35,;13.1,-12.68,;14.18,-13.76,;15.68,-13.36,;16.77,-14.46,;16.35,-15.96,;17.91,-16.7,;18.99,-15.61,;20.55,-15.7,;21.4,-14.41,;20.7,-13.01,;19.15,-12.94,;18.31,-14.23,;13.78,-15.26,;12.57,-15.58,;14.86,-16.35,;14.46,-17.85,;16,-18.01,;16.63,-19.41,;18.15,-19.58,;18.78,-20.99,;20.32,-21.16,;21.21,-19.9,;20.93,-22.56,;13.55,-19.09,;14.18,-20.5,;12.03,-18.92,)| | ||
Structure |