Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | COMT | P21964 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.34 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7323571 | 0.81 | MEN1 (0.36) | MEN1KMT2AESR1GAAESR2 | |
| SCHEMBL7312121 | 0.77 | CDK2 (0.50) | CDK2CA2FTOCA1CA9 | |
| SCHEMBL7326901 | 0.76 | CYP3A4 (0.44) | MEN1KMT2ATDP1 | |
| SCHEMBL30142423 | 0.75 | CDK2 (0.47) | MEN1KMT2ACDK2CA2FTO | |
| SCHEMBL7324884 | 0.72 | CA2 (0.44) | MEN1KMT2ACDK2CA2TDP1 | |
| SCHEMBL932121 | 0.72 | KMT2A (0.41) | MEN1KMT2AESR1GAAESR2 | |
| SCHEMBL9832298 | 0.71 | ALDH1A1 (0.41) | MEN1KMT2ATDP1 | |
| SCHEMBL4470614 | 0.71 | MEN1 (0.70) | MEN1KMT2AESR1GAAESR2 | |
| SCHEMBL7325090 | 0.70 | ACVR1 (0.41) | CDK2FTO | |
| SCHEMBL8560757 | 0.70 | CA1 (0.42) | CA2CA1CA9CA12CA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0287696-B1 | ISOQUINOLINE DERIVATIVES | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1991-01-02 | — | — | EP | disclosed |
| EP-0287696-A1 | Isoquinoline derivatives | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1988-10-26 | — | — | EP | disclosed |