Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.53 |
| ▸ | CA2 | P00918 | 3/20 | 0.53 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL527251 | 0.98 | CA1 (0.54) | CA1CA2CA12CA9CA14 | |
| SCHEMBL28521426 | 0.94 | CA1 (0.51) | CA1CA2CA12CA9CA14 | |
| SCHEMBL5918178 | 0.92 | SRD5A2 (0.58) | CA1CA2CA12CA9CA14 | |
| Benzoic Acid SCHEMBL28984654 | 0.90 | TSHR (0.58) | CA1CA2CA12CA9CA14 | |
| SCHEMBL109451 | 0.89 | CA1 (0.61) | CA1CA2CA12CA9CA14 | |
| SCHEMBL5918248 | 0.89 | PARP15 (0.55) | CA1CA2CA12CA9CA14 | |
| Ammonia Solution, Strong SCHEMBL27433728 | 0.85 | TDP1 (0.62) | CA1CA2CA12CA9CA14 | |
| Hydrazine SCHEMBL10771056 | 0.85 | CA12 (0.62) | CA1CA2CA12CA9CA14 | |
| Terephthalic Acid SCHEMBL11412636 | 0.83 | SLC7A5 (0.54) | CA1CA2CA12CA9CA14 | |
| SCHEMBL7115499 | 0.83 | TSHR (0.50) | CA1CA2CA12CA9CA14 |
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-1997007131-A1 | ACYLATED OLIGOPEPTIDES CONTAINING PHOSPHOTYROSINE AS INHIBITORS OF PROTEIN TYROSINE KINASES | NOVARTIS AG (CH) | 1997-02-27 | — | — | WO | disclosed |