Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22018774 | 0.76 | ALDH1A1 (0.55) | ALDH1A1POLBMAPTHTTTSHR | |
| SCHEMBL22019386 | 0.76 | ALDH1A1 (0.63) | ALDH1A1POLBCYP3A4MAPTTSHR | |
| SCHEMBL22018552 | 0.75 | RORC (0.69) | ALDH1A1CYP3A4RORCMAPTMAPK1 | |
| SCHEMBL22018563 | 0.73 | ALDH1A1 (0.50) | ALDH1A1POLBMAPTTSHRALOX15 | |
| SCHEMBL22018772 | 0.63 | ALDH1A1 (0.38) | ALDH1A1POLBCYP3A4RORCTSHR | |
| SCHEMBL22019402 | 0.62 | SMN1; SMN2 (0.46) | ALDH1A1POLBCYP3A4CYP2C19KMT2A | |
| SCHEMBL18559261 | 0.59 | MAPT (0.80) | ALDH1A1POLBMAPTTSHRALOX15 | |
| SCHEMBL22018990 | 0.59 | SMN1; SMN2 (0.47) | ALDH1A1POLBCYP3A4CYP2C19KMT2A | |
| SCHEMBL20952382 | 0.58 | TSHR (0.70) | ALDH1A1POLBCYP3A4RORCHTT | |
| SCHEMBL22018590 | 0.58 | ALDH1A1 (0.61) | ALDH1A1MAPTHTTTSHRALOX15 |
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 |