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Codeine

Codeine

SCHEMBL7936665

COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341.COc1ccc2c3c1O[C@H]1[C@@H](OP(=O)(O)O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341.O=S(=O)(O)O

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRD1OPRK1OPRM1

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

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 known ✓ P35372 13/20 0.77
▸ OPRK1 known ✓ P41145 10/20 0.77
▸ OPRD1 known ✓ P41143 5/20 0.77
▸ MRGPRX2 Q96LB1 2/20 0.77
▸ ADRB1 P08588 1/20 0.77
▸ PDE4D Q08499 1/20 0.77
▸ PDE3A Q14432 1/20 0.77

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
Codeine SCHEMBL7936660 0.93 OPRD1 (0.86) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL29479412 0.93 OPRM1 (0.82) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL24579 0.93 OPRM1 (0.82) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Water SCHEMBL30166501 0.92 OPRM1 (0.81) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Hydrochloric Acid SCHEMBL28121142 0.92 OPRM1 (0.81) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Water SCHEMBL6063509 0.92 OPRM1 (0.81) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Water SCHEMBL29938850 0.92 OPRM1 (0.81) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Codeine SCHEMBL24863 0.92 OPRD1 (0.91) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Codeine SCHEMBL24864 0.92 OPRD1 (0.91) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Codeine SCHEMBL38654010 0.92 OPRD1 (0.91) OPRM1OPRK1OPRD1MRGPRX2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6319514-B1 Analgesic and anti-inflammatory compositions comprising domperidone and methods of using same THE BOOTS COMPANY, PLC (GB) 2001-11-20 — — US claimed
CN-101163717-A Soluble glycosaminoglycanases and methods of preparing and using soluble glycosaminoglycanases HALOZYME THERAPEUTICS INC (US) 2008-04-16 — — CN disclosed