SCHEMBL30900788

SCHEMBL30900788

C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 12/20 0.60
▸ OPRM1 P35372 9/20 0.60
▸ OPRK1 P41145 2/20 0.60
▸ TFPI P10646 1/20 0.57
▸ OPRL1 P41146 2/20 0.56
▸ NPBWR1 P48145 3/20 0.55
▸ CCKAR P32238 1/20 0.53
▸ CCKBR P32239 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
SCHEMBL31243878 0.98 OPRD1 (0.59) OPRD1OPRM1OPRK1TFPIOPRL1
SCHEMBL31243865 0.96 OPRD1 (0.58) OPRD1OPRM1OPRK1TFPIOPRL1
SCHEMBL31243859 0.96 OPRD1 (0.58) OPRD1OPRM1OPRK1TFPIOPRL1
SCHEMBL31243857 0.95 OPRD1 (0.67) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL30900782 0.95 TFPI (0.65) OPRD1OPRM1OPRK1TFPIOPRL1
SCHEMBL30900790 0.95 TFPI (0.65) OPRD1OPRM1OPRK1TFPIOPRL1
SCHEMBL31243860 0.94 KISS1R (0.52) OPRD1OPRM1OPRK1TFPIOPRL1
SCHEMBL31243869 0.93 OPRD1 (0.69) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL31243908 0.93 OPRD1 (0.55) OPRD1OPRM1OPRK1TFPIOPRL1
SCHEMBL31243855 0.92 OPRD1 (0.59) OPRD1OPRM1OPRK1TFPIOPRL1

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
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