Ki Summary

Reaction Details

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Target

C5a anaphylatoxin chemotactic receptor 1

Ligand

BDBM50192040

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_394610 (CHEMBL910269)

IC50

535±n/a nM

Citation

Schnatbaum, K; Locardi, E; Scharn, D; Richter, U; Hawlisch, H; Knolle, J; Polakowski, T Peptidomimetic C5a receptor antagonists with hydrophobic substitutions at the C-terminus: increased receptor specificity and in vivo activity. Bioorg Med Chem Lett16:5088-92 (2006) [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

BDBM50192040

n/a

Name

BDBM50192040

Synonyms:

Ac-Phe-Orn-Pro-cha-Trp-Arg-OH | CHEMBL409977

Type

Small organic molecule

Emp. Form.

C47H67N11O8

Mol. Mass.

914.1038

SMILES

CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN)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:30.31,wD:26.28,4.3,55.59,15.15,41.43,(16.41,-6.42,;17.18,-7.76,;16.41,-9.1,;18.72,-7.76,;19.49,-6.43,;21.03,-6.43,;21.8,-7.77,;23.35,-7.76,;24.11,-9.1,;23.35,-10.43,;21.81,-10.43,;21.03,-9.1,;18.72,-5.1,;17.18,-5.1,;19.49,-3.76,;18.74,-2.41,;19.5,-1.08,;21.05,-1.08,;21.81,.26,;23.36,.25,;17.19,-2.41,;16.42,-3.75,;16.19,-.68,;16.97,.8,;15.77,1.82,;14.46,1.02,;14.82,-.48,;14.82,-2.02,;16.15,-2.79,;13.48,-2.79,;12.15,-2.02,;12.15,-.48,;10.82,.29,;10.81,1.84,;9.49,2.61,;8.16,1.84,;8.15,.3,;9.49,-.48,;10.82,-2.79,;9.49,-2.02,;10.82,-4.33,;9.49,-5.1,;9.49,-6.64,;10.78,-7.48,;12.18,-6.93,;13.17,-8.11,;12.37,-9.43,;12.8,-10.9,;11.72,-12.03,;10.24,-11.64,;9.8,-10.18,;10.87,-9.06,;8.16,-4.33,;8.16,-2.79,;6.82,-5.09,;5.49,-4.32,;4.15,-5.09,;2.81,-4.32,;1.48,-5.09,;.15,-4.32,;-1.18,-5.1,;-2.53,-4.33,;-1.2,-6.64,;5.49,-2.78,;6.82,-2,;4.15,-2.01,)|

Structure