Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HSPB1 | P04792 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | VCAM1 | P19320 | 7/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4730442 | 0.83 | ATM (0.39) | ATMTDP1HSPB1TSHRMAPK1 | |
| SCHEMBL4732570 | 0.81 | HSPB1 (0.43) | ATMTDP1HSPB1TSHRALDH1A1 | |
| SCHEMBL4732626 | 0.77 | ATM (0.40) | ATMTDP1HSPB1TSHRMAPK1 | |
| SCHEMBL4733059 | 0.76 | TRPV4 (0.33) | — | |
| SCHEMBL4730720 | 0.76 | HCAR2 (0.33) | TSHRALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL4732090 | 0.69 | AGBL2 (0.34) | ATMALDH1A1L3MBTL1 | |
| SCHEMBL687212 | 0.68 | TDP1 (0.59) | ATMTDP1TSHRMAPK1ALDH1A1 | |
| SCHEMBL6368 | 0.68 | TDP1 (0.64) | ATMTDP1HSPB1TSHRMAPK1 | |
| SCHEMBL29563244 | 0.68 | TDP1 (0.59) | ATMTDP1TSHRMAPK1ALDH1A1 | |
| SCHEMBL29537379 | 0.68 | TDP1 (0.64) | ATMTDP1HSPB1TSHRMAPK1 |
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-2008061029-A1 | ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE | WYETH (US) | 2008-05-22 | — | — | WO | disclosed |