Ki Summary

Reaction Details

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Target

N-formyl peptide receptor 2

Ligand

BDBM50238906

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1664517 (CHEMBL4014198)

IC50

15±n/a nM

Citation

Skovbakke, SL; Skovbakke, SL; Skovbakke, SL; Holdfeldt, A; Holdfeldt, A; Holdfeldt, A; Nielsen, C; Nielsen, C; Nielsen, C; Hansen, AM; Hansen, AM; Hansen, AM; Perez-Gassol, I; Perez-Gassol, I; Perez-Gassol, I; Dahlgren, C; Dahlgren, C; Dahlgren, C; Forsman, H; Forsman, H; Forsman, H; Franzyk, H; Franzyk, H; Franzyk, H Combining Elements from Two Antagonists of Formyl Peptide Receptor 2 Generates More Potent Peptidomimetic Antagonists. J Med Chem60:6991-6997 (2017) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

N-formyl peptide receptor 2

Name:

N-formyl peptide receptor 2

Synonyms:

Type:

G Protein-Coupled Receptor (GPCR)

Mol. Mass.:

38968.35

Organism:

Homo sapiens (Human)

Description:

P25090

Residue:

351

Sequence:

METNFSTPLNEYEEVSYESAGYTVLRILPLVVLGVTFVLGVLGNGLVIWVAGFRMTRTVT
TICYLNLALADFSFTATLPFLIVSMAMGEKWPFGWFLCKLIHIVVDINLFGSVFLIGFIA
LDRCICVLHPVWAQNHRTVSLAMKVIVGPWILALVLTLPVFLFLTTVTIPNGDTYCTFNF
ASWGGTPEERLKVAITMLTARGIIRFVIGFSLPMSIVAICYGLIAAKIHKKGMIKSSRPL
RVLTAVVASFFICWFPFQLVALLGTVWLKEMLFYGKYKIIDILVNPTSSLAFFNSCLNPM
LYVFVGQDFRERLIHSLPTSLERALSEDSAPTNDTAANSASPPAETELQAM

BDBM50238906

n/a

Name

BDBM50238906

Synonyms:

CHEMBL4081147

Type

Small organic molecule

Emp. Form.

C124H170N21O14

Mol. Mass.

2178.8084

SMILES

CCN(CC)c1ccc2c(-c3ccccc3C(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(N)=O)Cc3ccccc3)Cc3ccccc3)Cc3ccccc3)Cc3ccccc3)Cc3ccccc3)Cc3ccccc3)c3ccc(cc3oc2c1)=[N+](CC)CC |r,wU:33.34,47.48,61.62,89.90,wD:19.20,75.76,(17.08,-26.39,;15.75,-25.63,;15.75,-24.08,;17.08,-23.32,;18.4,-24.08,;14.4,-23.32,;14.39,-21.79,;13.07,-21.03,;11.74,-21.8,;10.41,-21.03,;10.4,-18.98,;9.05,-18.22,;9.05,-16.68,;10.39,-15.91,;11.71,-16.67,;11.71,-18.2,;13.04,-18.97,;13.04,-20.53,;14.4,-18.2,;15.75,-18.97,;15.75,-20.53,;17.07,-21.29,;17.07,-22.83,;18.41,-23.6,;19.73,-22.83,;17.09,-18.2,;17.09,-16.65,;18.43,-18.97,;18.44,-20.51,;19.76,-21.27,;21.09,-20.5,;21.1,-18.96,;22.43,-21.27,;23.75,-20.5,;23.76,-18.95,;25.09,-18.19,;25.08,-16.65,;26.41,-15.87,;26.41,-14.34,;25.09,-21.26,;25.1,-22.79,;26.42,-20.49,;27.75,-21.26,;27.76,-22.79,;29.09,-23.55,;30.42,-22.78,;29.09,-25.09,;30.43,-25.86,;31.76,-25.08,;33.09,-25.85,;34.42,-25.07,;35.75,-25.84,;37.08,-25.07,;30.43,-27.39,;29.1,-28.16,;31.76,-28.15,;31.77,-29.69,;30.44,-30.47,;30.44,-32,;31.77,-32.76,;29.11,-32.77,;29.12,-34.32,;30.45,-35.08,;30.46,-36.62,;31.79,-37.39,;33.13,-36.62,;34.46,-37.38,;27.78,-35.09,;26.45,-34.32,;27.79,-36.63,;29.12,-37.4,;29.13,-38.94,;27.8,-39.71,;26.46,-38.94,;27.8,-41.25,;26.47,-42.03,;25.13,-41.26,;23.8,-42.03,;22.46,-41.27,;21.13,-42.04,;19.79,-41.27,;26.47,-43.57,;27.81,-44.33,;25.14,-44.34,;25.14,-45.88,;23.81,-46.66,;23.81,-48.2,;25.15,-48.96,;22.48,-48.97,;22.48,-50.51,;23.82,-51.28,;23.82,-52.82,;25.16,-53.59,;26.49,-52.81,;27.83,-53.58,;21.15,-51.29,;19.81,-50.52,;21.15,-52.83,;22.49,-53.59,;22.49,-55.13,;23.83,-55.9,;23.83,-57.44,;25.16,-55.13,;19.82,-53.6,;18.48,-52.83,;18.49,-51.29,;17.15,-50.52,;15.82,-51.3,;15.82,-52.85,;17.16,-53.61,;23.8,-43.57,;22.47,-44.35,;21.13,-43.58,;19.8,-44.35,;19.8,-45.89,;21.15,-46.66,;22.47,-45.88,;26.46,-37.4,;25.12,-36.64,;25.12,-35.09,;23.79,-34.33,;22.45,-35.1,;22.46,-36.65,;23.8,-37.41,;33.09,-27.39,;34.42,-28.15,;34.42,-29.68,;35.76,-30.45,;37.09,-29.68,;37.08,-28.13,;35.75,-27.37,;26.42,-18.95,;27.75,-18.18,;29.08,-18.94,;30.4,-18.17,;30.4,-16.64,;29.06,-15.88,;27.74,-16.65,;19.76,-18.2,;19.75,-16.66,;21.09,-15.9,;21.09,-14.36,;19.75,-13.6,;18.42,-14.38,;18.43,-15.91,;9.07,-21.82,;7.75,-21.06,;6.43,-21.84,;6.45,-23.37,;7.76,-24.13,;9.09,-23.36,;10.43,-24.12,;11.75,-23.34,;13.09,-24.1,;5.1,-24.14,;3.76,-23.37,;2.43,-24.14,;5.1,-25.68,;3.76,-26.45,)|

Structure