Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.36 |
| ▸ | KCNQ4 | P56696 | 4/20 | 0.36 |
| ▸ | KCNQ5 | Q9NR82 | 4/20 | 0.36 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6675309 | 0.99 | CYP17A1 (0.38) | CYP17A1CA1CA2NR1H4KCNQ4 | |
| Hydrochloric Acid SCHEMBL7242318 | 0.99 | CYP17A1 (0.38) | CYP17A1CA1CA2NR1H4KCNQ4 | |
| SCHEMBL7248116 | 0.90 | CA1 (0.43) | CYP17A1CA1CA2MEN1KMT2A | |
| SCHEMBL6674728 | 0.79 | MEN1 (0.36) | CYP17A1MEN1KMT2AATMMAPK14 | |
| Hydrochloric Acid SCHEMBL7242320 | 0.78 | MEN1 (0.36) | CYP17A1MEN1KMT2AATMMAPK14 | |
| SCHEMBL6676258 | 0.78 | CA1 (0.43) | CA1CA2NR1H4MEN1KMT2A | |
| SCHEMBL7247586 | 0.77 | CA1 (0.43) | CA1CA2MEN1KMT2A | |
| SCHEMBL6681996 | 0.76 | MAPT (0.46) | CA1CA2MEN1KMT2AATM | |
| SCHEMBL29468015 | 0.75 | CYP17A1 (0.49) | CYP17A1CA1CA2KCNQ4KCNQ5 | |
| SCHEMBL16245955 | 0.74 | CYP17A1 (0.48) | CYP17A1KCNQ4KCNQ5MEN1KMT2A |
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-0798292-B1 | ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY | CHUGAI SEIYAKUKABUSHIKI KAISHA (JP) | 2004-11-03 | — | — | EP | claimed |