Sugi Predict

Sugi Predict / Compounds / SCHEMBL30093046

SCHEMBL30093046

SCHEMBL30093046

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EDNRA P25101 1/20 0.69
▸ ERAP2 Q6P179 7/20 0.64
▸ ECE1 P42892 6/20 0.62
▸ IL1RN P18510 6/20 0.59
▸ ERAP1 Q9NZ08 4/20 0.59
▸ ACE P12821 2/20 0.58
▸ KMT2A Q03164 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57

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
SCHEMBL30092892 0.97 EDNRA (0.68) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL30092989 0.97 EDNRA (0.68) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL30533184 0.96 EDNRA (0.76) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL29706359 0.96 EDNRA (0.68) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL30050836 0.95 EDNRA (0.63) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL30093051 0.95 EDNRA (0.63) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL30051778 0.95 ACE (0.64) EDNRAECE1ACEKMT2AL3MBTL1
SCHEMBL30051687 0.94 ECE1 (0.65) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL30051867 0.94 EDNRA (0.60) EDNRAERAP2ECE1IL1RNERAP1
SCHEMBL29531276 0.92 ERAP2 (0.73) ERAP2ECE1IL1RNERAP1ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115397836-A Novel antibacterial peptide and application thereof 安尼根有限公司 2022-11-25 — — CN disclosed