Ki Summary

Reaction Details

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Target

Prostate-specific antigen

Ligand

BDBM50326051

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_655597 (CHEMBL1244641)

2900±n/a nM

Citation

Heinis, C; Rutherford, T; Freund, S; Winter, G Phage-encoded combinatorial chemical libraries based on bicyclic peptides. Nat Chem Biol5:502-7 (2009) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Prostate-specific antigen

Name:

Prostate-specific antigen

Synonyms:

Type:

PROTEIN

Mol. Mass.:

28747.53

Organism:

Homo sapiens (Human)

Description:

ChEMBL_959198

Residue:

261

Sequence:

MWVPVVFLTLSVTWIGAAPLILSRIVGGWECEKHSQPWQVLVASRGRAVCGGVLVHPQWV
LTAAHCIRNKSVILLGRHSLFHPEDTGQVFQVSHSFPHPLYDMSLLKNRFLRPGDDSSHD
LMLLRLSEPAELTDAVKVMDLPTQEPALGTTCYASGWGSIEPEEFLTPKKLQCVDLHVIS
NDVCAQVHPQKVTKFMLCAGRWTGGKSTCSGDSGGPLVCNGVLQGITSWGSEPCALPERP
SLYTKVVHYRKWIKDTIVANP

BDBM50326051

n/a

Name

BDBM50326051

Synonyms:

(2R,5S,8S,11R,14S,17S,20S)-14,17-bis((1H-imidazol-5-yl)methyl)-8-((1H-indol-3-yl)methyl)-20-((2S,5R,8S,11S,14S,17R)-17-amino-2-sec-butyl-8-(4-hydroxybenzyl)-14-isopropyl-18-mercapto-5-(mercaptomethyl)-11-methyl-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazaoctadecanamido)-5-((R)-1-hydroxyethyl)-2,11-bis(mercaptomethyl)-4,7,10,13,16,19-hexaoxo-3,6,9,12,15,18-hexaazatricosane-1,23-dioic acid | CHEMBL1240616

Type

Small organic molecule

Emp. Form.

C67H94N18O18S4

Mol. Mass.

1567.833

SMILES

CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CS)C(O)=O |r|

Structure