Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.61 |
| ▸ | HPGD | P15428 | 7/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | GAA | P10253 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL34468504 | 0.78 | ALDH1A1 (0.66) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL11493125 | 0.77 | ALDH1A1 (0.76) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL13438093 | 0.72 | MAPT (0.64) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL8289729 | 0.72 | MAPT (0.67) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL8288727 | 0.72 | MAPT (0.64) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL34468628 | 0.72 | ALDH1A1 (0.62) | ALDH1A1HPGDMEN1KMT2AGAA | |
| SCHEMBL8289649 | 0.72 | ALDH1A1 (0.65) | ALDH1A1HPGDMEN1KMT2AGAA | |
| SCHEMBL34468572 | 0.71 | ALDH1A1 (0.61) | ALDH1A1HPGDMEN1KMT2AGAA | |
| SCHEMBL10406531 | 0.71 | KMT2A (0.75) | ALDH1A1HPGDMEN1KMT2AGAA | |
| SCHEMBL16265428 | 0.71 | MEP1B (0.66) | ALDH1A1MEN1KMT2AGAAPOLB |
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-2005033102-A2 | THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF | AMPHORA DISCOVERY CORPORATION (US) | 2005-04-14 | — | — | WO | disclosed |