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Sugi Predict / Compounds / Dihydrocodeine

Dihydrocodeine

Dihydrocodeine

SCHEMBL16105089

CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)CC[C@H]3[C@H]1C5.COc1ccc2c3c1O[C@H]1[C@@H](O)CC[C@H]4[C@@H](C2)N(C)CC[C@@]341

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1

The experimentally established mechanism targets of Dihydrocodeine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 known ✓ P35372 10/20 0.77
▸ OPRD1 P41143 12/20 0.77
▸ OPRK1 P41145 8/20 0.77
▸ PDE4D Q08499 2/20 0.77
▸ MRGPRX2 Q96LB1 2/20 0.77
▸ LMNA P02545 1/20 0.77
▸ ADRB1 P08588 1/20 0.52
▸ PDE3A Q14432 1/20 0.52

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
Hydrocodone SCHEMBL1683551 1.00 OPRD1 (0.77) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Hydrocodone SCHEMBL18230599 0.96 OPRM1 (0.83) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Hydromorphone SCHEMBL18230602 0.94 OPRD1 (0.84) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Hydrocodone SCHEMBL1360903 0.93 OPRM1 (0.89) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Dihydrocodeine SCHEMBL20788663 0.91 OPRD1 (0.70) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Codeine SCHEMBL3239478 0.88 OPRM1 (0.72) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Codeine SCHEMBL250022 0.88 OPRM1 (0.72) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Hydrocodone SCHEMBL12013631 0.88 OPRD1 (1.00) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Hydrocodone SCHEMBL12402839 0.88 OPRD1 (1.00) OPRD1OPRM1OPRK1PDE4DMRGPRX2
Hydrocodone SCHEMBL21335350 0.88 OPRD1 (1.00) OPRD1OPRM1OPRK1PDE4DMRGPRX2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170056329-A1 Pharmaceutical Compositions for the Deterrence and/or Prevention of Abuse ALPHARMA PHARMACEUTICALS LLC (US) 2017-03-02 — — US claimed
US-20150024058-A1 Pharmaceutical Compositions for the Deterrence and/or Prevention of Abuse ALPHARMA PHARMACEUTICALS LLC (US) 2015-01-22 — — US claimed
US-8846104-B2 Pharmaceutical compositions for the deterrence and/or prevention of abuse ALPHARMA PHARMACEUTICALS LLC (US) 2014-09-30 — — US claimed