Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 SCHEMBL6674491 | 0.99 | NR1H4 (0.36) | NR1H4CA12CA1CA2CA9 | |
| SCHEMBL6674904 | 0.85 | AOC1 (0.32) | — | |
| SCHEMBL27544117 | 0.84 | NR1H4 (0.35) | NR1H4CA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL6680940 | 0.84 | AOC1 (0.34) | — | |
| SCHEMBL6676319 | 0.82 | NR1H4 (0.35) | NR1H4KCNB1ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL7236369 | 0.81 | NR1H4 (0.34) | NR1H4KCNB1LMNA | |
| SCHEMBL6675982 | 0.81 | PTGIR (0.38) | NR1H4CA12CA1CA2CA9 | |
| SCHEMBL6674705 | 0.81 | HTT (0.37) | NR1H4KCNB1ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL6674495 | 0.80 | SIGMAR1 (0.38) | NR1H4CA12CA1CA2CA9 | |
| SCHEMBL6674456 | 0.78 | IDO1 (0.38) | MEN1KMT2AGAAMAPTALOX12 |
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 |