Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 7/20 | 0.55 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8916429 | 1.00 | FDPS (0.55) | FDPSSMPD1HDAC1HDAC2HDAC3 | |
| SCHEMBL10494867 | 0.94 | FDPS (0.57) | FDPSSMPD1HDAC1HDAC2HDAC3 | |
| Water SCHEMBL10494859 | 0.92 | FDPS (0.56) | FDPSSMPD1HDAC1HDAC2HDAC3 | |
| SCHEMBL10494895 | 0.81 | FDPS (0.58) | FDPSSMPD1HDAC1HDAC2HDAC3 | |
| SCHEMBL10494882 | 0.77 | ALDH1A1 (0.48) | FDPSSMPD1ALDH1A1NPC1RAB9A | |
| SCHEMBL7614028 | 0.75 | ALDH1A1 (0.53) | FDPSHDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL5167895 | 0.74 | ALDH1A1 (0.74) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| SCHEMBL5169003 | 0.74 | ALDH1A1 (0.74) | HDAC1HDAC2HDAC3HDAC4HDAC7 | |
| Phosphoric Acid SCHEMBL11703957 | 0.73 | ALDH1A1 (0.54) | FDPSHDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL11152425 | 0.73 | ALDH1A1 (0.58) | HDAC1HDAC2HDAC3HDAC4HDAC7 |
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-5624917-A | Method of inhibiting squalene synthetase | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-04-29 | — | — | US | claimed |