Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.47 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.47 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | GRM6 | O15303 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4054047 | 0.87 | TDP1 (0.44) | ALDH1A1TDP1TSHRHPGDALOX15 | |
| SCHEMBL691025 | 0.85 | TDP1 (0.59) | ALDH1A1TDP1CYP3A4TSHRHPGD | |
| SCHEMBL16901738 | 0.79 | GPR35 (0.44) | ALDH1A1TDP1CYP3A4TSHRHPGD | |
| SCHEMBL9736340 | 0.79 | VCAM1 (0.49) | ALDH1A1TDP1HPGDALOX15HIF1A | |
| SCHEMBL10675000 | 0.79 | TDP1 (0.53) | ALDH1A1TDP1CYP3A4TSHRHPGD | |
| SCHEMBL8431056 | 0.78 | CYP3A4 (0.70) | ALDH1A1TDP1CYP3A4TSHRHPGD | |
| SCHEMBL8162628 | 0.78 | TDP1 (0.60) | ALDH1A1TDP1CYP3A4TSHRHPGD | |
| SCHEMBL8429156 | 0.78 | ALDH1A1 (0.64) | ALDH1A1TDP1CYP3A4TSHRHPGD | |
| SCHEMBL15851030 | 0.78 | TDP1 (0.51) | ALDH1A1TDP1CYP3A4TSHRHPGD | |
| SCHEMBL30673260 | 0.78 | GPR35 (0.48) | ALDH1A1TDP1TSHRHPGDALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-4051252-A | ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-27 | — | — | US | disclosed |