Ki Summary

Reaction Details

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Target

C5a anaphylatoxin chemotactic receptor 1

Ligand

BDBM50077498

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_41605 (CHEMBL650558)

IC50

9120±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

BDBM50077498

n/a

Name

BDBM50077498

Synonyms:

(R)-2-[(S)-2-[(R)-2-({(R)-1-[(S)-2-((S)-2-Amino-3-phenyl-propionylamino)-propionyl]-pyrrolidine-2-carbonyl}-amino)-3-cyclohexyl-propionylamino]-3-(1H-indol-3-yl)-propionylamino]-5-guanidino-pentanoic acid | CHEMBL2373303

Type

Small organic molecule

Emp. Form.

C43H60N10O7

Mol. Mass.

828.9993

SMILES

C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)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:35.37,1.0,wD:20.22,24.25,49.53,5.5,(8.22,-4.33,;7.98,-5.83,;6.55,-6.4,;5.35,-5.43,;5.75,-3.94,;3.87,-5.83,;2.77,-4.74,;3.47,-7.31,;4.57,-8.41,;4.17,-9.9,;5.27,-10.98,;6.76,-10.57,;7.15,-9.08,;6.06,-7.99,;9.19,-6.81,;8.94,-8.32,;10.62,-6.25,;11,-4.77,;12.55,-4.68,;13.1,-6.11,;11.9,-7.09,;13.23,-7.84,;14.56,-7.09,;13.23,-9.37,;14.56,-10.15,;15.84,-9.29,;17.2,-10,;18.81,-9.34,;19.43,-8.16,;19.8,-9.67,;18.14,-10.39,;17.57,-11.49,;15.31,-11.45,;16.84,-11.45,;14.53,-12.78,;15.62,-13.86,;17.1,-13.48,;18.2,-14.56,;17.78,-16.05,;19.32,-16.79,;20.41,-15.69,;21.94,-15.79,;22.8,-14.51,;22.09,-13.13,;20.55,-13.03,;19.71,-14.34,;15.22,-15.36,;14.01,-15.67,;16.3,-16.45,;15.89,-17.93,;17.42,-18.08,;18.04,-19.48,;19.58,-19.65,;20.19,-21.06,;21.72,-21.22,;22.61,-19.98,;22.34,-22.62,;14.99,-19.16,;15.62,-20.56,;13.48,-19.01,)|

Structure