SCHEMBL30900787

SCHEMBL30900787

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1cccnc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.52
▸ OPRD1 P41143 1/20 0.52
▸ CTSD P07339 3/20 0.52
▸ ACE P12821 7/20 0.51
▸ KISS1R Q969F8 3/20 0.50
▸ NPY1R P25929 1/20 0.49
▸ NPY2R P49146 1/20 0.49
▸ NPY4R P50391 1/20 0.49
▸ NTSR2 O95665 1/20 0.49
▸ NTSR1 P30989 1/20 0.49
▸ MME P08473 1/20 0.48
▸ CPA1 P15085 1/20 0.48
▸ ACE2 Q9BYF1 1/20 0.48
▸ FOLH1 Q04609 1/20 0.47

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
SCHEMBL30845376 0.92 NPY1R (0.56) OPRM1OPRD1ACEKISS1RNPY1R
SCHEMBL34467263 0.91 ACE (0.61) OPRM1OPRD1CTSDACEKISS1R
SCHEMBL29713848 0.87 ACE (0.58) OPRM1OPRD1CTSDACEKISS1R
SCHEMBL30541918 0.86 ACE (0.62) OPRM1OPRD1ACEMMECPA1
SCHEMBL29369469 0.86 FOLH1 (0.57) OPRM1OPRD1ACENPY1RNPY2R
SCHEMBL31482342 0.86 FOLH1 (0.57) OPRM1OPRD1ACENPY1RNPY2R
SCHEMBL30519203 0.85 MME (0.54) OPRM1OPRD1ACEMME
SCHEMBL30900760 0.84 ACE (0.61) CTSDACENPY1RNPY2RNPY4R
SCHEMBL29394485 0.83 OPRD1 (0.51) OPRM1OPRD1CTSDKISS1R
SCHEMBL30900781 0.83 ACE (0.60) OPRM1OPRD1CTSDACENPY1R

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-118021646-A Application of boletus peptide and derivatives thereof in cosmetics 上海湃肽生物科技有限公司 2024-05-14 — — CN disclosed
Send feedback