Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.45 |
| ▸ | PI4KA | P42356 | 1/20 | 0.45 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL26985275 | 0.82 | CYP3A4 (0.48) | ALDH1A1CYP3A4TSHRTP53SMN1; SMN2 | |
| SCHEMBL14549327 | 0.79 | SMN1; SMN2 (0.61) | ALDH1A1TP53SMN1; SMN2GAAHTT | |
| SCHEMBL9885168 | 0.77 | SMN1; SMN2 (0.71) | ALDH1A1CYP3A4TSHRTP53SMN1; SMN2 | |
| SCHEMBL9963480 | 0.75 | SMN1; SMN2 (0.68) | ALDH1A1CYP3A4TSHRTP53SMN1; SMN2 | |
| SCHEMBL6985206 | 0.75 | NPC1 (0.68) | ALDH1A1SMN1; SMN2GAAHTTL3MBTL1 | |
| SCHEMBL211024 | 0.75 | RAB9A (0.66) | ALDH1A1CYP3A4SMN1; SMN2GAAHTT | |
| Hydrochloric Acid SCHEMBL4680538 | 0.74 | RAB9A (0.64) | ALDH1A1CYP3A4SMN1; SMN2GAAHTT | |
| Bromide SCHEMBL10947640 | 0.74 | RAB9A (0.64) | ALDH1A1CYP3A4SMN1; SMN2GAAHTT | |
| SCHEMBL23858344 | 0.73 | CYP3A4 (0.58) | ALDH1A1CYP3A4TSHRTP53SMN1; SMN2 | |
| SCHEMBL6058100 | 0.73 | HSD17B10 (0.47) | ALDH1A1CYP3A4TSHRTP53SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE29724-E | NYLON, WITH AN ANTHRAQUINONE DYE CONTAINING CYCLIC ANHYDRIDE (FORMING) GROUPS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1978-08-08 | — | — | US | disclosed |