SCHEMBL29461574

SCHEMBL29461574

C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.59
▸ KDM4E B2RXH2 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ PTGS2 P35354 1/20 0.50
▸ THPO P40225 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ BLM P54132 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ MME P08473 7/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ NOD1 Q9Y239 1/20 0.41
▸ TGFBR1 P36897 3/20 0.41
▸ FOLH1 Q04609 1/20 0.40
▸ DPP4 P27487 1/20 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
SCHEMBL29569220 0.93 ACE (0.54) ACEKDM4EMAPTTHRBALOX15
SCHEMBL31696942 0.91 ACE (0.65) ACEKDM4EMAPTTHRBALOX15
SCHEMBL28303549 0.91 ACE (0.69) ACEKDM4EMAPTTHRBALOX15
SCHEMBL29516656 0.91 ACE (0.69) ACEKDM4EMAPTTHRBALOX15
SCHEMBL29511093 0.91 ACE (0.69) ACEKDM4EMAPTTHRBALOX15
SCHEMBL29476622 0.91 ACE (0.69) ACEKDM4EMAPTTHRBALOX15
SCHEMBL2544386 0.91 ACE (0.69) ACEKDM4EMAPTTHRBALOX15
SCHEMBL2544384 0.91 ACE (0.69) ACEKDM4EMAPTTHRBALOX15
Water SCHEMBL2599751 0.90 ACE (0.67) ACEKDM4EMAPTTHRBALOX15
SCHEMBL31599213 0.90 ACE (0.67) ACEKDM4EMAPTTHRBALOX15

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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-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
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-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
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