Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.37 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL91821 | 0.89 | MAPT (0.43) | MAPTCYP1A2CYP2C19AKR1C3AKR1C2 | |
| SCHEMBL91846 | 0.87 | MAPT (0.45) | MAPTCYP1A2CYP2C19ROCK1TP53 | |
| SCHEMBL91819 | 0.85 | MAPT (0.37) | MAPTCYP1A2CYP2C19AKR1C3AKR1C2 | |
| SCHEMBL91860 | 0.82 | MAPT (0.38) | MAPTCYP1A2CYP2C19AKR1C3AKR1C2 | |
| SCHEMBL91859 | 0.79 | ALDH1A1 (0.37) | MAPTCYP1A2CYP2C19AKR1C3AKR1C2 | |
| SCHEMBL91795 | 0.77 | AKR1C3 (0.45) | MAPTAKR1C3AKR1C2AKR1B10AKR1C4 | |
| SCHEMBL10018721 | 0.76 | KMT2A (0.53) | MAPTCYP1A2CYP2C19NPC1TDP1 | |
| SCHEMBL18553115 | 0.75 | AKR1C3 (0.46) | MAPTAKR1C3AKR1C2AKR1B10AKR1C4 | |
| SCHEMBL18853806 | 0.73 | MAPT (0.58) | MAPTCYP1A2CYP2C19TP53KMT2A | |
| SCHEMBL14016869 | 0.72 | ALDH1A1 (0.51) | MAPTCYP1A2CYP2C19NPC1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |
| US-7419706-B2 | Liquid crystalline medium | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2008-09-02 | — | — | US | disclosed |