SCHEMBL31240179

SCHEMBL31240179

CC(C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 7/20 0.62
▸ IL1RN P18510 5/20 0.62
▸ OPRD1 P41143 2/20 0.58
▸ CCKAR P32238 1/20 0.58
▸ CCKBR P32239 1/20 0.58
▸ ACE P12821 2/20 0.55
▸ ERAP1 Q9NZ08 4/20 0.55
▸ NPY1R P25929 3/20 0.55
▸ NPY2R P49146 3/20 0.55
▸ NPY4R P50391 3/20 0.55
▸ ECE1 P42892 2/20 0.54
▸ OPRM1 P35372 1/20 0.53
▸ LNPEP Q9UIQ6 1/20 0.53

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
SCHEMBL31483387 0.91 ERAP2 (0.62) ERAP2IL1RNOPRD1ERAP1NPY1R
SCHEMBL30202334 0.89 ERAP2 (0.60) ERAP2IL1RNOPRD1CCKARCCKBR
SCHEMBL29350564 0.89 ERAP2 (0.63) ERAP2IL1RNOPRD1CCKARCCKBR
SCHEMBL30567421 0.89 ERAP2 (0.62) ERAP2IL1RNOPRD1ERAP1NPY1R
SCHEMBL30051739 0.89 ACE (0.67) ERAP2ACEECE1
SCHEMBL30052892 0.89 ACE (0.67) ERAP2ACEECE1
SCHEMBL31303497 0.88 ERAP2 (0.61) ERAP2IL1RNOPRD1ERAP1NPY1R
SCHEMBL31303469 0.88 ERAP2 (0.61) ERAP2IL1RNOPRD1ERAP1NPY1R
SCHEMBL31388803 0.88 ERAP2 (0.72) ERAP2IL1RNACEERAP1ECE1
SCHEMBL30457908 0.87 CCKBR (0.58) ERAP2IL1RNOPRD1CCKARCCKBR

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-118666953-A Active peptide with anti-intestinal injury caused by drinking as well as preparation method and application thereof 深圳市罗湖区人民医院 2024-09-20 — — CN claimed
CN-118666953-A Active peptide with anti-intestinal injury caused by drinking as well as preparation method and application thereof 深圳市罗湖区人民医院 2024-09-20 — — CN disclosed
CN-118666953-A Active peptide with anti-intestinal injury caused by drinking as well as preparation method and application thereof 深圳市罗湖区人民医院 2024-09-20 — — CN disclosed
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