SCHEMBL29461716

SCHEMBL29461716

C[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.40
▸ ECE1 P42892 6/20 0.39
▸ MME P08473 4/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30547095 0.95 ACE (0.43) ACEECE1MME
SCHEMBL31113634 0.93 CTRB1 (0.36) ACEMME
SCHEMBL17293240 0.93 CTRB1 (0.37) ACEMME
SCHEMBL3916119 0.93 CTRB1 (0.37) ACEMME
SCHEMBL9665720 0.93 CTRB1 (0.37) ACEMME
SCHEMBL749822 0.93 CTRB1 (0.37) ACEMME
SCHEMBL3810013 0.93 CTRB1 (0.37) ACEMME
SCHEMBL29511173 0.93 CTRB1 (0.37) ACEMME
SCHEMBL749821 0.93 CTRB1 (0.37) ACEMME
SCHEMBL3916112 0.93 CTRB1 (0.37) ACEMME

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112094316-B High-zinc-chelating-activity zinc chelating peptide with Ser and Cys arranged at two ends and application thereof 安徽省农业科学院农产品加工研究所 2022-04-08 — — CN disclosed
CN-111909238-B High-zinc-chelation-activity zinc chelating peptide containing Ser-Cys and application thereof 安徽省农业科学院农产品加工研究所 2022-04-08 — — CN disclosed
CN-111925411-B Cys-Ser-containing high-zinc-chelating-activity zinc chelating peptide and application thereof 安徽省农业科学院农产品加工研究所 2022-04-08 — — CN disclosed
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