Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL287408 | 0.94 | RAB9A (0.43) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL287825 | 0.88 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL287518 | 0.87 | ALDH1A1 (0.35) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL287767 | 0.84 | HPGD (0.42) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL287419 | 0.84 | NPC1 (0.41) | ALDH1A1KMT2ANPC1RAB9APOLB | |
| SCHEMBL287274 | 0.84 | ALDH1A1 (0.33) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL287813 | 0.81 | ALDH1A1 (0.45) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL287139 | 0.81 | ALDH1A1 (0.38) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL288004 | 0.80 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL286788 | 0.80 | MAPT (0.35) | ALDH1A1MEN1KMT2ANPC1RAB9A |
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-2427432-A2 | NOVEL HETEROCYCLIC COMPOUNDS | Torrent Pharmaceuticals Limited (IN) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128528-A2 | NOVEL HETEROCYCLIC COMPOUNDS | TORRENT PHARMACEUTICALS LIMITED (IN) | 2010-11-11 | — | — | WO | disclosed |