Ki Summary

Reaction Details

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Target

C5a anaphylatoxin chemotactic receptor 1

Ligand

BDBM50077491

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_41454 (CHEMBL652975)

IC50

5900±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:

MDSFNYTTPDYGHYDDKDTLDLNTPVDKTSNTLRVPDILALVIFAVVFLVGVLGNALVVW
VTAFEAKRTINAIWFLNLAVADFLSCLALPILFTSIVQHHHWPFGGAACSILPSLILLNM
YASILLLATISADRFLLVFKPIWCQNFRGAGLAWIACAVAWGLALLLTIPSFLYRVVREE
YFPPKVLCGVDYSHDKRRERAVAIVRLVLGFLWPLLTLTICYTFILLRTWSRRATRSTKT
LKVVVAVVASFFIFWLPYQVTGIMMSFLEPSSPTFLLLKKLDSLCVSFAYINCCINPIIY
VVAGQGFQGRLRKSLPSLLRNVLTEESVVRESKSFTRSTVDTMAQKTQAV

BDBM50077491

n/a

Name

BDBM50077491

Synonyms:

(R)-2-[(S)-2-[(R)-2-({(R)-1-[(S)-2-((S)-2-Amino-3-phenyl-propionylamino)-3-(1H-indol-3-yl)-propionyl]-pyrrolidine-2-carbonyl}-amino)-3-cyclohexyl-propionylamino]-3-(1H-indol-3-yl)-propionylamino]-5-guanidino-pentanoic acid | CHEMBL2373431

Type

Small organic molecule

Emp. Form.

C51H65N11O7

Mol. Mass.

944.1313

SMILES

N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)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:12.12,44.48,wD:29.33,33.36,58.64,1.0,(2.47,-7.05,;3.8,-7.85,;3.78,-9.4,;5.11,-10.18,;6.45,-9.42,;7.78,-10.22,;7.76,-11.76,;6.42,-12.52,;5.09,-11.73,;5.14,-7.1,;5.17,-5.54,;6.64,-7.51,;7.73,-6.43,;7.33,-4.94,;8.41,-3.85,;9.94,-4.09,;10.65,-2.73,;9.55,-1.64,;9.64,-.11,;8.36,.73,;6.98,.04,;6.9,-1.49,;8.19,-2.32,;9.21,-6.82,;9.6,-8.3,;10.65,-6.27,;11.03,-4.78,;12.58,-4.69,;13.14,-6.12,;11.94,-7.11,;13.26,-7.86,;14.6,-7.11,;13.26,-9.4,;14.6,-10.18,;15.89,-9.32,;17.25,-10.02,;17.62,-11.53,;18.19,-10.42,;19.86,-9.7,;19.49,-8.19,;18.86,-9.37,;15.35,-11.48,;16.89,-11.48,;14.57,-12.82,;15.66,-13.9,;17.15,-13.51,;18.25,-14.6,;17.83,-16.09,;19.38,-16.84,;20.47,-15.74,;22,-15.84,;22.86,-14.55,;22.15,-13.16,;20.61,-13.07,;19.76,-14.38,;15.26,-15.4,;14.05,-15.71,;16.34,-16.49,;15.94,-17.98,;17.47,-18.13,;18.09,-19.54,;19.63,-19.7,;20.24,-21.11,;21.78,-21.27,;22.67,-20.03,;22.4,-22.68,;15.03,-19.21,;15.66,-20.62,;13.51,-19.06,)|

Structure