Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.41 |
| ▸ | S100B | P04271 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GABRP | O00591 | 1/20 | 0.39 |
| ▸ | GABRD | O14764 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL7473758 | 0.90 | ALDH1A1 (0.54) | ALDH1A1MITFHSP90AA1HTTATM | |
| SCHEMBL7473148 | 0.85 | MAPK14 (0.44) | ALDH1A1POLBTNK2MAPTLMNA | |
| SCHEMBL7476794 | 0.82 | HSD17B10 (0.41) | ALDH1A1HTTMAPTSRD5A2LMNA | |
| SCHEMBL7475152 | 0.81 | MAPK14 (0.44) | ALDH1A1HTTALOX15POLBTNK2 | |
| SCHEMBL7468981 | 0.79 | CYP11B1 (0.41) | ALDH1A1HTTMAPTKMT2ALMNA | |
| SCHEMBL7477253 | 0.79 | KDM4E (0.49) | ALDH1A1MITFHSP90AA1HTTATM | |
| SCHEMBL7479585 | 0.78 | ALDH1A1 (0.39) | ALDH1A1MITFHSP90AA1HTTATM | |
| SCHEMBL7471841 | 0.78 | MAPK14 (0.44) | ALDH1A1MITFHSP90AA1HTTATM | |
| SCHEMBL7470573 | 0.77 | ALDH1A1 (0.44) | ALDH1A1ALOX15POLBTNK2MAPT | |
| SCHEMBL7470949 | 0.76 | KDM4E (0.49) | ALDH1A1HSP90AA1ATMNPSR1TLR9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1077701-A4 | ANTI-VIRAL COMPOUNDS | LILLY CO ELI (US) | 2002-03-20 | — | — | EP | disclosed |
| EP-1077701-A1 | ANTI-VIRAL COMPOUNDS | ELI LILLY AND COMPANY (US) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999059587-A1 | ANTI-VIRAL COMPOUNDS | ELI LILLY AND COMPANY (US) | 1999-11-25 | — | — | WO | disclosed |