Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 10/20 | 0.42 |
| ▸ | CA1 | P00915 | 9/20 | 0.42 |
| ▸ | CA9 | Q16790 | 4/20 | 0.42 |
| ▸ | TIMP3 | P35625 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 5/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 5/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 5/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 5/20 | 0.38 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NT5E | P21589 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9902951 | 0.80 | SNCA (0.41) | TIMP3RAPGEF4ALDH1A1TSHRNT5E | |
| SCHEMBL11516706 | 0.80 | CA2 (0.45) | CA2CA1CA9PDK1PDK2 | |
| SCHEMBL149756 | 0.79 | ALDH1A1 (0.44) | CA2CA1CA9TIMP3ALDH1A1 | |
| SCHEMBL11716215 | 0.76 | CA2 (0.49) | CA2CA1CA9PDK1PDK2 | |
| SCHEMBL11721290 | 0.76 | CA2 (0.71) | CA2CA1CA9ALDH1A1TSHR | |
| SCHEMBL8981201 | 0.74 | CASP6 (0.43) | CA2CA1TIMP3ALDH1A1TSHR | |
| SCHEMBL28007870 | 0.74 | TIMP3 (0.41) | CA2CA1TIMP3RAPGEF4ALDH1A1 | |
| SCHEMBL5009133 | 0.74 | ALDH1A1 (0.44) | CA2CA1CA9TIMP3RAPGEF4 | |
| SCHEMBL9636254 | 0.73 | ALDH1A1 (0.41) | CA2CA1CA9ALDH1A1 | |
| SCHEMBL8564902 | 0.73 | MEN1 (0.47) | CA2CA1ALDH1A1HSD17B10TDP1 |
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 |