Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10692785 | 0.88 | CYP3A4 (0.69) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL10691491 | 0.86 | CYP3A4 (0.67) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL10933649 | 0.82 | TDP1 (0.56) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL9481735 | 0.79 | ALDH1A1 (0.82) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL10689289 | 0.78 | ALDH1A1 (0.82) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL2905368 | 0.78 | ALDH1A1 (0.68) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL7007875 | 0.78 | TDP1 (0.59) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL11642078 | 0.78 | ALDH1A1 (0.42) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL29381342 | 0.78 | ALDH1A1 (0.79) | CYP3A4ALDH1A1TDP1HPGDHIF1A | |
| SCHEMBL311267 | 0.78 | ALDH1A1 (0.79) | CYP3A4ALDH1A1TDP1HPGDHIF1A |
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 |
|---|---|---|---|---|---|---|---|
| US-4732991-A | Substituted phthalides | HILTON DAVIS CHEMICAL CO. (US) | 1988-03-22 | — | — | US | disclosed |
| US-4595768-A | 3-(substituted phenyl)phthalides | THE HILTON-DAVIS CHEMICAL CO. (US) | 1986-06-17 | — | — | US | disclosed |