Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.40 |
| ▸ | PTGIR | P43119 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TPH1 | P17752 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 SCHEMBL7238983 | 0.99 | ADRA2A (0.42) | KDM4ERECQLADRA2APTGIRALDH1A1 | |
| SCHEMBL6681428 | 0.99 | KDM4E (0.41) | KDM4ERECQLADRA2APTGIRALDH1A1 | |
| Hydrochloric Acid SCHEMBL6681785 | 0.98 | ADRA2A (0.43) | KDM4ERECQLADRA2APTGIRALDH1A1 | |
| SCHEMBL6679310 | 0.80 | KDM4E (0.40) | KDM4ERECQLALDH1A1MEN1KMT2A | |
| SCHEMBL6674750 | 0.78 | KDM4E (0.43) | KDM4ERECQLALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7238980 | 0.77 | KDM4E (0.43) | KDM4ERECQLALDH1A1MEN1KMT2A | |
| SCHEMBL6681425 | 0.77 | KDM4E (0.44) | KDM4ERECQLALDH1A1MEN1KMT2A | |
| SCHEMBL6676318 | 0.76 | PTGIR (0.47) | ADRA2APTGIR | |
| SCHEMBL6676057 | 0.76 | PTGIR (0.47) | ADRA2APTGIR | |
| SCHEMBL6678176 | 0.76 | PTGIR (0.47) | ADRA2APTGIR |
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 |