Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 7/20 | 0.59 |
| ▸ | CES2 | O00748 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | GMNN | O75496 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | FAAH | O00519 | 4/20 | 0.50 |
| ▸ | PLA2G6 | O60733 | 1/20 | 0.50 |
| ▸ | PLA2G4B | P0C869 | 6/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7698121 | 0.92 | CES2 (0.68) | CES1CES2MAPTGMNNTP53 | |
| SCHEMBL14535085 | 0.90 | CES1 (0.55) | CES1CES2MAPTGMNNTP53 | |
| SCHEMBL19141213 | 0.83 | CES2 (0.63) | CES1CES2MAPTGMNNTP53 | |
| SCHEMBL980424 | 0.82 | — | — | |
| SCHEMBL2452425 | 0.82 | — | — | |
| SCHEMBL911321 | 0.82 | — | — | |
| SCHEMBL9130822 | 0.80 | — | — | |
| SCHEMBL27883674 | 0.80 | GMNN (0.59) | CES1CES2MAPTGMNNTP53 | |
| SCHEMBL26447117 | 0.80 | CES2 (0.48) | CES1CES2MAPTGMNNTP53 | |
| SCHEMBL7375408 | 0.80 | — | — |
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-4454141-A | Trans-B/C-7-(1-hydroxypentyl)-3-methoxy-17 methyl-6,7-didehydromorphinans, and methods of relieving pain with them | SISA PHARMACEUTICAL LABORATORIES, INC. (US) | 1984-06-12 | — | — | US | disclosed |