Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | PI4KA | P42356 | 4/20 | 0.39 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.39 |
| ▸ | PIP5K1C | O60331 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2899732 | 0.82 | ALDH1A1 (0.59) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| SCHEMBL29462442 | 0.82 | ALDH1A1 (0.59) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| Nitrogen SCHEMBL27684908 | 0.79 | ALDH1A1 (0.55) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| Pyrazole SCHEMBL28081707 | 0.77 | PI4KA (0.46) | TP53SMN1; SMN2CYP3A4ALDH1A1PI4KA | |
| SCHEMBL1638626 | 0.69 | AXL (0.53) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| SCHEMBL26927659 | 0.69 | SMN1; SMN2 (0.72) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| SCHEMBL10201412 | 0.69 | ALDH1A1 (0.52) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| SCHEMBL16238119 | 0.69 | SMN1; SMN2 (0.72) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| SCHEMBL29741763 | 0.69 | CYP3A4 (0.53) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR | |
| SCHEMBL21091211 | 0.69 | CYP3A4 (0.53) | TP53SMN1; SMN2CYP3A4ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-105820596-A | Tetrahydroquinoline dye, ink and electrowetting display | 深圳市国华光电科技有限公司 | 2016-08-03 | — | — | CN | disclosed |