Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | PI4KA | P42356 | 1/20 | 0.46 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9722790 | 0.85 | CYP3A4 (0.59) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL31114638 | 0.85 | CYP3A4 (0.59) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL11103550 | 0.82 | TP53 (0.61) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL11605061 | 0.79 | CYP3A4 (0.53) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| Hydrochloric Acid SCHEMBL11562944 | 0.79 | CYP3A4 (0.60) | CYP3A4CYP1A2CYP2C19PIK3CAPI4KA | |
| SCHEMBL21186197 | 0.78 | TP53 (0.57) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL21186238 | 0.78 | AXL (0.57) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL21186212 | 0.78 | CYP3A4 (0.68) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL9722731 | 0.75 | CYP3A4 (0.56) | TP53SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL31081320 | 0.75 | CYP3A4 (0.49) | TP53SMN1; SMN2MAPTRAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019141980-A1 | AGRICULTURAL CHEMICALS | GLOBACHEM NV (BE) | 2019-07-25 | — | — | WO | disclosed |