Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.75 |
| ▸ | CLK1 | P49759 | 4/20 | 0.75 |
| ▸ | HTT | P42858 | 2/20 | 0.75 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.75 |
| ▸ | MAPT | P10636 | 2/20 | 0.75 |
| ▸ | POLB | P06746 | 2/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.75 |
| ▸ | MEN1 | O00255 | 1/20 | 0.75 |
| ▸ | AHR | P35869 | 1/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | MET | P08581 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28643433 | 0.86 | CLK1 (1.00) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL11254906 | 0.85 | ALDH1A1 (0.75) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL2555063 | 0.81 | MET (0.63) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL2542595 | 0.81 | ALDH1A1 (0.57) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL3137839 | 0.79 | PIK3CA (0.82) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL2576731 | 0.79 | MET (0.65) | ALDH1A1CLK1HTTKMT2AMAPT | |
| Fluoride SCHEMBL24503906 | 0.78 | KMT2A (0.70) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL2763569 | 0.78 | MET (0.59) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL2554477 | 0.76 | MET (0.62) | ALDH1A1CLK1HTTKMT2AMAPT | |
| SCHEMBL612904 | 0.76 | MET (0.64) | ALDH1A1CLK1HTTKMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011121223-A1 | 6-(ALKYL- OR CYCLOALKYL-TRIAZOLOPYRIDAZINE-SULFANYL) BENZOTHIAZOLE DERIVATIVES: PREPARATION, APPLICATION AS MEDICAMENTS AND USE AS MET INHIBITORS | SANOFI-AVENTIS (FR) | 2011-10-06 | — | — | WO | disclosed |