SCHEMBL30712173

SCHEMBL30712173

CC(C)C[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 2/20 0.52
▸ ERAP1 Q9NZ08 1/20 0.52
▸ LNPEP Q9UIQ6 1/20 0.52
▸ FOLH1 Q04609 2/20 0.47
▸ CPB2 Q96IY4 6/20 0.46
▸ BACE1 P56817 3/20 0.44
▸ CTSD P07339 2/20 0.44
▸ GNPAT O15228 1/20 0.42
▸ ECE1 P42892 1/20 0.42
▸ NPY1R P25929 1/20 0.42
▸ NPY2R P49146 1/20 0.42
▸ NPY4R P50391 1/20 0.42
▸ NOD1 Q9Y239 1/20 0.41

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
SCHEMBL29760953 0.91 ERAP2 (0.53) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL29898192 0.91 ERAP2 (0.56) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL30714839 0.91 FOLH1 (0.52) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL29496718 0.91 ERAP2 (0.58) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL29456901 0.91 ERAP2 (0.58) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL1711266 0.91 ERAP2 (0.58) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL10928123 0.91 ERAP2 (0.58) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL1711264 0.91 ERAP2 (0.58) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL29714923 0.91 ERAP2 (0.58) ERAP2ERAP1LNPEPFOLH1CPB2
SCHEMBL29532168 0.90 BACE1 (0.46) ERAP2ERAP1LNPEPFOLH1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117210441-B Low-temperature salt-tolerant beta-glucosidase and application thereof in conversion of ginsenoside Rb1 云南师范大学 2024-09-20 — — CN disclosed
CN-117210441-A Low-temperature salt-tolerant beta-glucosidase and application thereof in conversion of ginsenoside Rb1 云南师范大学 2023-12-12 — — CN disclosed
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