SCHEMBL11525882

SCHEMBL11525882

C[C@@H](NC(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N(N)C(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 12/20 0.59
OPRM1 P35372 7/20 0.59
OPRK1 P41145 1/20 0.59
PSMB1 P20618 2/20 0.49
PSMB9 P28065 2/20 0.49
PSMB5 P28074 2/20 0.49
PSMB10 P40306 2/20 0.49
PSMB2 P49721 2/20 0.49
PSMB8 P28062 1/20 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
SCHEMBL11350815 0.81 OPRD1 (0.52) OPRD1OPRM1OPRK1PSMB1PSMB9
SCHEMBL11525876 0.81 PSMB1 (0.50) OPRD1OPRM1OPRK1PSMB1PSMB9
SCHEMBL11567403 0.80 OPRD1 (0.47) OPRD1OPRM1OPRK1PSMB1PSMB9
SCHEMBL11122625 0.78 OPRD1 (0.62) OPRD1OPRM1OPRK1
SCHEMBL11569802 0.77 PSMB10 (0.46) PSMB1PSMB9PSMB5PSMB10PSMB2
SCHEMBL30631019 0.77 PSMB1 (0.61) OPRD1OPRM1OPRK1PSMB1PSMB9
SCHEMBL11357211 0.76 PSMB10 (0.44) OPRD1OPRM1OPRK1PSMB1PSMB9
SCHEMBL11566754 0.76 PSMB1 (0.61) PSMB1PSMB9PSMB5PSMB10PSMB2
SCHEMBL21430318 0.76 REN (0.59) PSMB1PSMB9PSMB5PSMB10PSMB2
SCHEMBL11349856 0.75 LTA4H (0.51) PSMB1PSMB9PSMB5PSMB10PSMB2

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
US-4148785-A Analgesic polypeptide AMERICAN HOME PRODUCTS CORPORATION (US) 1979-04-10 US disclosed