SCHEMBL29588041

SCHEMBL29588041

CC(C)C[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 8/20 0.60
▸ ECE1 P42892 5/20 0.53
▸ ERAP1 Q9NZ08 6/20 0.51
▸ ANPEP P15144 1/20 0.51
▸ IL1RN P18510 6/20 0.51
▸ MMP1 P03956 2/20 0.50
▸ MMP2 P08253 3/20 0.49
▸ MMP9 P14780 2/20 0.49
▸ MMP8 P22894 2/20 0.49
▸ ACE P12821 2/20 0.49

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
SCHEMBL29802507 0.92 ERAP2 (0.54) ERAP2ECE1ERAP1ANPEPACE
SCHEMBL30166489 0.92 ECE1 (0.61) ERAP2ECE1ERAP1ANPEPIL1RN
SCHEMBL30436333 0.92 ECE1 (0.61) ERAP2ECE1ERAP1ANPEPIL1RN
SCHEMBL30974109 0.91 ERAP2 (0.58) ERAP2ECE1ERAP1IL1RN
SCHEMBL29519893 0.90 ERAP2 (0.58) ERAP2ECE1ERAP1ANPEPIL1RN
SCHEMBL31126208 0.90 ERAP2 (0.51) ERAP2ECE1ERAP1ANPEPIL1RN
SCHEMBL31031484 0.90 ERAP2 (0.52) ERAP2ECE1ERAP1IL1RNMMP1
SCHEMBL29663506 0.89 GHSR (0.52) ERAP2ECE1ERAP1ANPEPIL1RN
SCHEMBL30988538 0.89 ERAP2 (0.56) ERAP2ECE1ERAP1ANPEPIL1RN
SCHEMBL30561494 0.89 ERAP2 (0.56) ERAP2ECE1ERAP1ANPEPIL1RN

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-114409730-A Active peptide, active peptide composition and application of active peptide composition in preparation of product with anti-aging effect 深圳科兴药业有限公司 2022-04-29 — — CN disclosed
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