Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL538804 | 1.00 | LMNA (0.54) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL10350181 | 1.00 | LMNA (0.54) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL5176548 | 1.00 | LMNA (0.54) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL5078093 | 0.94 | TDP1 (0.51) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL29696492 | 0.91 | TDP1 (0.46) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL10497654 | 0.88 | CES2 (0.51) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL9716955 | 0.88 | ALDH1A1 (0.51) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL8154501 | 0.88 | TSHR (0.48) | LMNATSHRALDH1A1TDP1TP53 | |
| SCHEMBL27946955 | 0.87 | CES2 (0.50) | LMNATSHRALDH1A1TDP1TP53 | |
| Hexyl Acetate SCHEMBL28561509 | 0.86 | TDP1 (0.47) | LMNATSHRALDH1A1TDP1TP53 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1059911-A1 | FORMULATIONS WITH AN ANTI-VIRAL EFFECT | MERCK PATENT GmbH (DE) | 2000-12-20 | — | — | EP | disclosed |
| WO-1999044578-A1 | FORMULATIONS WITH AN ANTI-VIRAL EFFECT | MERCK PATENT GMBH (DE) | 1999-09-10 | — | — | WO | disclosed |