Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8871152 | 0.89 | CYP3A4 (0.40) | CYP3A4CYP2C9MAPTHTTPOLB | |
| SCHEMBL9218483 | 0.85 | CYP3A4 (0.39) | CYP3A4CYP2C9MAPTHTTPOLB | |
| SCHEMBL8871352 | 0.84 | POLB (0.42) | MAPTPOLBRAB9AHDAC3HDAC4 | |
| SCHEMBL8872566 | 0.80 | MAPT (0.41) | CYP3A4CYP2C9MAPTHTTRAB9A | |
| SCHEMBL17157482 | 0.79 | MAPT (0.45) | CYP3A4CYP2C9MAPTHTTPOLB | |
| SCHEMBL30628314 | 0.79 | MAPT (0.45) | CYP3A4CYP2C9MAPTHTTPOLB | |
| SCHEMBL8871178 | 0.78 | CYP3A4 (0.58) | CYP3A4CYP2C9HDAC3HDAC4HDAC1 | |
| SCHEMBL8871941 | 0.74 | POLB (0.38) | CYP3A4CYP2C9MAPTPOLBRAB9A | |
| SCHEMBL8637486 | 0.74 | MAPT (0.42) | CYP2C9MAPTHTTPOLBRAB9A | |
| SCHEMBL8872271 | 0.74 | POLB (0.48) | MAPTHTTPOLBSMN1; SMN2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5605921-A | Triazole derivatives and salts thereof, and antifungal agent containing the same | TOYAMA CHEMICAL CO., LTD. (JP) | 1997-02-25 | — | — | US | disclosed |
| US-5366989-A | Triazole derivatives and salts thereof and antifungal agent containing the same | TOYAMA CHEMICAL CO., LTD. (JP) | 1994-11-22 | — | — | US | disclosed |
| EP-0546529-A1 | Triazole derivatives and salts thereof, processes for producing the same, and antifungal agent containing the same | TOYAMA CHEMICAL CO., LTD. (JP) | 1993-06-16 | — | — | EP | disclosed |