Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CASP6 | P55212 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31532623 | 0.92 | CTDSP1 (0.52) | CTDSP1ALDH1A1TDP1CYP3A4PKM | |
| SCHEMBL158764 | 0.92 | CTDSP1 (0.52) | CTDSP1ALDH1A1TDP1CYP3A4PKM | |
| Nitrogen SCHEMBL28911658 | 0.89 | CTDSP1 (0.50) | CTDSP1ALDH1A1HSD17B10TDP1CYP3A4 | |
| SCHEMBL153646 | 0.85 | ALDH1A1 (0.59) | CTDSP1ALDH1A1HSD17B10CYP2C9CYP2C19 | |
| SCHEMBL142003 | 0.85 | ALDH1A1 (0.59) | CTDSP1ALDH1A1HSD17B10CYP2C9CYP2C19 | |
| SCHEMBL9401917 | 0.84 | CTDSP1 (0.47) | CTDSP1ALDH1A1CASP6TDP1CYP3A4 | |
| SCHEMBL142001 | 0.83 | ALDH1A1 (0.57) | CTDSP1ALDH1A1HSD17B10CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL28203178 | 0.83 | ALDH1A1 (0.57) | CTDSP1ALDH1A1HSD17B10CYP2C9CYP2C19 | |
| SCHEMBL7064778 | 0.83 | ALDH1A1 (0.57) | CTDSP1ALDH1A1HSD17B10CYP2C9CYP2C19 | |
| SCHEMBL9637465 | 0.80 | TIMP3 (0.44) | ALDH1A1HSD17B10PKMGAAMEN1 |
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-5175261-A | Useful for coloring cellulose materials, animal furs or leather | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-12-29 | — | — | US | disclosed |