Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.88 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.88 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.88 |
| ▸ | RAB9A | P51151 | 2/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.76 |
| ▸ | NPC1 | O15118 | 1/20 | 0.76 |
| ▸ | CASP3 | P42574 | 1/20 | 0.76 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.76 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.76 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.76 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9084215 | 1.00 | CYP1A2 (0.88) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL17266522 | 0.98 | CYP1A2 (0.90) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL10458108 | 0.93 | CYP1A2 (1.00) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL13698952 | 0.88 | CYP1A2 (0.68) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL5708657 | 0.88 | CYP1A2 (0.68) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL10421957 | 0.86 | RAB9A (1.00) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL8621890 | 0.86 | CYP1A2 (0.70) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL8918661 | 0.84 | CYP1A2 (0.62) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL8617387 | 0.83 | CYP1A2 (0.65) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 | |
| SCHEMBL9081746 | 0.83 | CYP1A2 (0.65) | CYP1A2CYP2D6CYP2C19RAB9ASMN1; SMN2 |
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-5624917-A | Method of inhibiting squalene synthetase | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-04-29 | — | — | US | disclosed |
| EP-0541037-A2 | Squalene synthetase inhibitory composition and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-05-12 | — | — | EP | disclosed |