Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KLK7 | P49862 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 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 | |
|---|---|---|---|---|
| SCHEMBL1201869 | 0.73 | CYP3A4 (0.46) | CYP3A4MAPTALDH1A1KDM4ECA2 | |
| SCHEMBL4571012 | 0.73 | CYP3A4 (0.46) | CYP3A4MAPTALDH1A1KDM4ECA2 | |
| SCHEMBL29422790 | 0.73 | CYP3A4 (0.46) | CYP3A4MAPTALDH1A1KDM4ECA2 | |
| SCHEMBL4559539 | 0.70 | PDE4A (0.38) | CYP3A4MAPTALDH1A1KDM4ECA2 | |
| SCHEMBL4561819 | 0.70 | CYP3A4 (0.34) | CYP3A4MAPTCA9ACHE | |
| SCHEMBL1276533 | 0.67 | CYP3A4 (0.59) | CYP3A4MAPTALDH1A1KDM4ECA2 | |
| SCHEMBL28383858 | 0.67 | SNCA (0.53) | CYP3A4MAPTALDH1A1KDM4EMAOA | |
| SCHEMBL4532734 | 0.62 | CYP3A4 (0.53) | CYP3A4MAPTALDH1A1KDM4ECA2 | |
| SCHEMBL11496731 | 0.62 | ALDH1A1 (0.63) | CYP3A4MAPTALDH1A1KDM4ECA2 | |
| SCHEMBL1711296 | 0.62 | CYP3A4 (0.53) | CYP3A4MAPTALDH1A1KDM4EMAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012062975-A1 | NOVEL TRIARYLMETHYL RADICALS: PREPARATION AND USE THEREOF | PHOSPHOENIX SARL (FR) | 2012-05-18 | — | — | WO | disclosed |
| WO-2012062975-A1 | NOVEL TRIARYLMETHYL RADICALS: PREPARATION AND USE THEREOF | PHOSPHOENIX SARL (FR) | 2012-05-18 | — | — | WO | disclosed |