Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.84 |
| ▸ | HPGD | P15428 | 5/20 | 0.84 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.84 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.84 |
| ▸ | USP2 | O75604 | 4/20 | 0.77 |
| ▸ | LMNA | P02545 | 2/20 | 0.77 |
| ▸ | GAA | P10253 | 3/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | POLB | P06746 | 5/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 6/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | THRB | P10828 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11920013 | 0.92 | ALDH1A1 (1.00) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL30585133 | 0.79 | ALDH1A1 (0.62) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL21045391 | 0.79 | ALDH1A1 (0.64) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL30585134 | 0.79 | ALDH1A1 (0.62) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL21045570 | 0.79 | ALDH1A1 (0.62) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL22692837 | 0.78 | ALDH1A1 (0.67) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL21045441 | 0.78 | ALDH1A1 (0.67) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL8289713 | 0.77 | ALDH1A1 (0.71) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL21045544 | 0.77 | ALDH1A1 (0.74) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 | |
| SCHEMBL21045485 | 0.76 | ALDH1A1 (0.77) | ALDH1A1HPGDHSD17B10SMN1; SMN2USP2 |
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 |