Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | GRM5 | P41594 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | VEGFA | P15692 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2966016 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2964860 | 0.86 | ALDH1A1 (0.52) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2958198 | 0.81 | MAPT (0.50) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2958969 | 0.76 | DTYMK (0.52) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2965489 | 0.74 | ALDH1A1 (0.47) | ALDH1A1CYP1A2GAAHPGDMAPK1 | |
| SCHEMBL5064405 | 0.72 | KMT2A (0.60) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL17740373 | 0.69 | VEGFA (0.55) | ALDH1A1MAPTTP53SMN1; SMN2HTT | |
| SCHEMBL17740331 | 0.69 | VEGFA (0.48) | ALDH1A1TP53SMN1; SMN2MAPK1LMNA | |
| SCHEMBL5536182 | 0.68 | VEGFA (0.68) | MAPTTP53SMN1; SMN2GAAHPGD | |
| SCHEMBL31466182 | 0.68 | KMT2A (0.64) | ALDH1A1MAPTCYP2C19SMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7772237-B2 | Thio-substituted tricyclic and bicyclic aromatic methanesulfinyl derivatives | CEPHALON FRANCE (FR) | 2010-08-10 | — | — | US | disclosed |