Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.80 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.80 |
| ▸ | HPGD | P15428 | 8/20 | 0.80 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.80 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | CASP1 | P29466 | 3/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 6/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.60 |
| ▸ | POLB | P06746 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | PKM | P14618 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15731000 | 0.83 | ALDH1A1 (0.76) | ALDH1A1KDM4EHPGDKMT2AHSD17B10 | |
| SCHEMBL15281387 | 0.75 | ALDH1A1 (0.63) | ALDH1A1KDM4EHPGDKMT2AHSD17B10 | |
| SCHEMBL28024073 | 0.73 | KMT2A (0.54) | ALDH1A1HPGDKMT2ATSHRMAPT | |
| SCHEMBL18598325 | 0.70 | MAPT (0.73) | ALDH1A1KDM4EHPGDKMT2AHSD17B10 | |
| SCHEMBL13753395 | 0.68 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDKMT2ATSHR | |
| SCHEMBL18180861 | 0.67 | RAB9A (0.70) | ALDH1A1HPGDKMT2AHSD17B10TSHR | |
| SCHEMBL4018260 | 0.66 | NPC1 (0.61) | ALDH1A1HPGDKMT2ATSHRNPSR1 | |
| SCHEMBL12050744 | 0.65 | ALDH1A1 (0.63) | ALDH1A1KDM4EHPGDKMT2AHSD17B10 | |
| SCHEMBL22804219 | 0.64 | RAB9A (0.70) | ALDH1A1HPGDKMT2AHSD17B10TSHR | |
| SCHEMBL4020988 | 0.64 | RAB9A (0.70) | ALDH1A1KDM4EHPGDKMT2AHSD17B10 |
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 |