Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 18/20 | 1.00 |
| ▸ | NPC1 | O15118 | 1/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.72 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.72 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.72 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.72 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.72 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.72 |
| ▸ | BLM | P54132 | 1/20 | 0.71 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.71 |
| ▸ | DRD4 | P21917 | 1/20 | 0.71 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.71 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.71 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9735327 | 0.99 | OPRK1 (0.98) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10338867 | 0.84 | OPRK1 (1.00) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6622624 | 0.84 | OPRK1 (1.00) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9734087 | 0.83 | OPRK1 (0.71) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9734090 | 0.83 | OPRK1 (0.71) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9730605 | 0.83 | OPRK1 (0.95) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL8435659 | 0.83 | OPRK1 (1.00) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7642844 | 0.83 | OPRK1 (1.00) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9734221 | 0.83 | OPRK1 (0.98) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9731858 | 0.82 | OPRK1 (0.98) | OPRK1NPC1CYP1A2CYP3A4CYP2D6 |
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-5114945-A | Spiropiperidine derivatives | GLAXO GROUP LIMITED (GB) | 1992-05-19 | — | — | US | disclosed |