Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA7 | P43166 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | NOX4 | Q9NPH5 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | LCK | P06239 | 2/20 | 0.50 |
| ▸ | RGS12 | O14924 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL18331069 | 0.92 | CA1 (0.59) | PTPN1KMT2APKMALDH1A1CA1 | |
| SCHEMBL4582016 | 0.86 | PTPN1 (0.51) | PTPN1KMT2APKMALDH1A1CA1 | |
| SCHEMBL2130340 | 0.80 | CA1 (0.59) | PTPN1KMT2AALDH1A1CA1CA2 | |
| SCHEMBL16221624 | 0.78 | MCL1 (0.71) | KMT2APKMALDH1A1TSHRMAPT | |
| SCHEMBL24784811 | 0.77 | KMT2A (0.57) | PTPN1KMT2APKMALDH1A1CA1 | |
| SCHEMBL6754521 | 0.77 | KDM4E (0.59) | PTPN1KMT2APKMALDH1A1CA1 | |
| SCHEMBL727904 | 0.77 | KDM4C (0.57) | KMT2APKMALDH1A1CA1CA2 | |
| SCHEMBL19502707 | 0.77 | KDM4C (0.57) | PTPN1KMT2APKMALDH1A1CA1 | |
| SCHEMBL12041031 | 0.77 | EPHX2 (0.61) | KMT2APKMALDH1A1CA1CA2 | |
| SCHEMBL28927837 | 0.77 | KDM4C (0.57) | PTPN1KMT2APKMALDH1A1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0002231-A1 | 1-N-aryl-1,4-dihydropyridines, process for their preparation and their pharmaceutical application | BAYER AG (DE) | 1979-06-13 | — | — | EP | disclosed |