Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 9/20 | 0.96 |
| ▸ | MAPT | P10636 | 8/20 | 0.96 |
| ▸ | MEN1 | O00255 | 8/20 | 0.96 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.96 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.96 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.96 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.96 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.96 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.96 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.96 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.96 |
| ▸ | HTT | P42858 | 6/20 | 0.74 |
| ▸ | BLM | P54132 | 5/20 | 0.74 |
| ▸ | LMNA | P02545 | 5/20 | 0.74 |
| ▸ | THRB | P10828 | 4/20 | 0.74 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.74 |
| ▸ | POLB | P06746 | 4/20 | 0.74 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.74 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.74 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL9437122 | 0.99 | KMT2A (0.98) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| Iodide SCHEMBL9437119 | 0.99 | KMT2A (0.98) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| SCHEMBL12821744 | 0.99 | KMT2A (0.98) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| SCHEMBL12821746 | 0.99 | KMT2A (0.98) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| Iodide SCHEMBL5329489 | 0.98 | KMT2A (1.00) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| Iodide SCHEMBL5329486 | 0.98 | KMT2A (1.00) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| Perchlorate SCHEMBL10521396 | 0.95 | MAPT (0.90) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| Iodide SCHEMBL9768656 | 0.91 | MAPT (0.87) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| Iodide SCHEMBL8067949 | 0.91 | MAPT (0.87) | KMT2AMAPTMEN1ALDH1A1ALOX12 | |
| Perchlorate SCHEMBL11638443 | 0.88 | MAPT (0.78) | KMT2AMAPTMEN1ALDH1A1ALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1627635-B1 | Benzothiazolium compounds for use in methods of inhibiting NO production and TNF alpha and treating coronaviral infection | NAT HEALTH RESEARCH INSTITUTES (TW) | 2009-10-07 | — | — | EP | disclosed |