SCHEMBL30506405

SCHEMBL30506405

NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 4/20 0.54
▸ LTA4H P09960 1/20 0.51
▸ MME P08473 1/20 0.49
▸ GRPR P30550 1/20 0.49
▸ ANPEP P15144 1/20 0.48
▸ ERAP2 Q6P179 1/20 0.48
▸ ERAP1 Q9NZ08 1/20 0.48

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
SCHEMBL31721034 0.98 GHSR (0.54) GHSRLTA4HMMEANPEPERAP2
SCHEMBL30254250 0.95 ACE (0.50) GHSRLTA4HERAP2
SCHEMBL30506400 0.95 ERAP2 (0.56) GHSRGRPRANPEPERAP2ERAP1
SCHEMBL30462941 0.93 NPY1R (0.52) GHSRERAP2ERAP1
SCHEMBL30506402 0.93 LTA4H (0.58) GHSRLTA4HMMEANPEPERAP2
SCHEMBL30958546 0.93 LTA4H (0.58) GHSRLTA4HMMEANPEPERAP2
SCHEMBL29577979 0.92 LTA4H (0.57) GHSRLTA4HMMEANPEPERAP2
SCHEMBL29577130 0.92 LTA4H (0.57) GHSRLTA4HMMEANPEPERAP2
SCHEMBL30671563 0.91 LTA4H (0.58) GHSRLTA4HMMEANPEPERAP2
SCHEMBL30123606 0.91 NPY1R (0.52) GHSRERAP2

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-116554268-A Pancreatic lipase inhibitory peptide and application thereof 华南理工大学 2023-08-08 — — CN disclosed
Send feedback