Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | DGKA | P23743 | 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 | |
|---|---|---|---|---|
| SCHEMBL7709366 | 0.86 | ALDH1A1 (0.37) | ALDH1A1CYP2C9CYP2C19CNR2CNR1 | |
| SCHEMBL7603084 | 0.83 | HPGD (0.37) | ALDH1A1KDM4ESMN1; SMN2MAPTHPGD | |
| SCHEMBL25909326 | 0.76 | MEN1 (0.44) | ALDH1A1TDP1CYP4F2CYP4A11CYP1A2 | |
| SCHEMBL7580544 | 0.76 | CYP4F2 (0.54) | ALDH1A1CYP2C9CYP2C19TDP1KDM4E | |
| SCHEMBL7572306 | 0.69 | THRA (0.43) | ALDH1A1CYP2C9CYP2C19KDM4ECYP1A2 | |
| SCHEMBL6984457 | 0.69 | BRD4 (0.41) | ALDH1A1CYP1A2TNFBRD4 | |
| SCHEMBL7607076 | 0.69 | CYP4F2 (0.52) | ALDH1A1CYP2C9CYP2C19TDP1KDM4E | |
| SCHEMBL7575492 | 0.67 | RARB (0.55) | ALDH1A1HPGD | |
| SCHEMBL17922634 | 0.66 | CYP4F2 (0.46) | ALDH1A1CYP2C9CYP2C19TDP1KDM4E | |
| SCHEMBL6328916 | 0.66 | MAPT (0.55) | ALDH1A1SMN1; SMN2MAPTBRD4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002096913-A1 | SUBSTITUTED DI(HYDROXY/ALKOXY)SILICON PHTHALOCYANINES AND THEIR USES | GENTIAN AS (NO) | 2002-12-05 | — | — | WO | disclosed |
| EP-1238016-A1 | SUBSTITUTED PHTHALOCYANINES AND THEIR PRECURSORS | Gentian AS (NO) | 2002-09-11 | — | — | EP | disclosed |
| WO-2001042368-A1 | SUBSTITUTED PHTHALOCYANINES AND THEIR PRECURSORS | GENTIAN AS (NO) | 2001-06-14 | — | — | WO | disclosed |