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SCHEMBL11525876

SCHEMBL11525876

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

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PSMB1 P20618 4/20 0.50
▸ PSMB9 P28065 3/20 0.50
▸ PSMB5 P28074 3/20 0.50
▸ PSMB8 P28062 2/20 0.50
▸ PSMB10 P40306 2/20 0.50
▸ PSMB2 P49721 2/20 0.50
▸ OPRD1 P41143 8/20 0.47
▸ OPRM1 P35372 6/20 0.47
▸ OPRK1 P41145 1/20 0.47
▸ YAP1 P46937 3/20 0.47
▸ BCL2 P10415 1/20 0.44
▸ REN P00797 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MMP8 P22894 1/20 0.42
▸ LTA4H P09960 1/20 0.42

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
SCHEMBL11349836 0.88 LTA4H (0.45) PSMB1PSMB9PSMB5PSMB8PSMB10
SCHEMBL11357211 0.88 PSMB10 (0.44) PSMB1PSMB9PSMB5PSMB8PSMB10
SCHEMBL11349851 0.81 LTA4H (0.48) YAP1LTA4H
SCHEMBL11525882 0.81 OPRD1 (0.59) PSMB1PSMB9PSMB5PSMB8PSMB10
SCHEMBL10939289 0.78 ITGA4 (0.41) —
SCHEMBL9011301 0.76 REN (0.46) PSMB1PSMB9PSMB5PSMB8PSMB10
SCHEMBL10945238 0.76 ITGA4 (0.41) —
SCHEMBL10947130 0.76 ITGA4 (0.41) —
SCHEMBL10788353 0.75 NPY4R (0.50) OPRD1OPRM1OPRK1
SCHEMBL10829286 0.75 NPY4R (0.50) OPRD1OPRM1OPRK1

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