Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16801447 | 0.70 | ALDH1A1 (0.55) | ALDH1A1CYP1A2THRBHPGDHSD17B10 | |
| SCHEMBL19975710 | 0.67 | L3MBTL1 (0.36) | ALDH1A1HPGDHSD17B10NPC1MAPT | |
| SCHEMBL19992730 | 0.66 | L3MBTL1 (0.40) | ALDH1A1CYP1A2HPGDHSD17B10MEN1 | |
| SCHEMBL20967607 | 0.65 | L3MBTL1 (0.40) | ALDH1A1THRBHPGDHSD17B10MEN1 | |
| SCHEMBL19546812 | 0.65 | L3MBTL1 (0.58) | ALDH1A1HPGDHSD17B10MEN1NPC1 | |
| SCHEMBL17192976 | 0.65 | L3MBTL1 (0.37) | ALDH1A1THRBHPGDHSD17B10MEN1 | |
| Propene SCHEMBL27670742 | 0.64 | ALDH1A1 (0.52) | ALDH1A1CYP1A2THRBHPGDHSD17B10 | |
| SCHEMBL18673282 | 0.64 | ALDH1A1 (0.41) | ALDH1A1CYP1A2THRBHPGDHSD17B10 | |
| SCHEMBL18893037 | 0.63 | L3MBTL1 (0.40) | ALDH1A1CYP1A2HPGDHSD17B10MEN1 | |
| SCHEMBL21883465 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015082046-A2 | SUBSTITUTED OXEPINES | MERCK PATENT GMBH (DE) | 2015-06-11 | — | — | WO | disclosed |