Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 16/20 | 0.68 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.64 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.60 |
| ▸ | DRD4 | P21917 | 1/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.60 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.60 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.57 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL8819811 | 0.95 | OPRK1 (0.62) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL7947009 | 0.95 | OPRK1 (0.62) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL7647035 | 0.95 | OPRK1 (0.62) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| SCHEMBL9515474 | 0.83 | OPRK1 (0.80) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL10417793 | 0.83 | HPGD (0.51) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| SCHEMBL9514408 | 0.81 | OPRK1 (1.00) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL9734432 | 0.81 | OPRK1 (0.71) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| Maleic Acid SCHEMBL9734427 | 0.81 | OPRK1 (0.71) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9734739 | 0.80 | OPRK1 (0.98) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9733562 | 0.80 | OPRK1 (0.98) | OPRK1UTS2ROPRD1CYP3A4CYP2D6 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6174891-B1 | A MORPHINAN DERIVTIVE AS A POTENT AND FAST-ACTING OPIATE KAPPA RECEPTOR FOR THE RELIEF OF PURITIS DUE TO DERMATOSES WITH INFLAMMATION OR AN INTERNAL DISEASE (MALIGNANT TUMORS, DIABETES MELLITUS, HEPATIC DISEASES, GOUT; RENAL FAILURE | TORAY INDUSTRIES, INC. (JP) | 2001-01-16 | — | — | US | disclosed |