Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 5/20 | 0.41 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 0.39 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7355195 | 0.90 | F2 (0.42) | ALDH1A1F2FNTAFNTBPGGT1B | |
| Hydrochloric Acid SCHEMBL7356248 | 0.89 | F2 (0.54) | ALDH1A1F2GAATSHRPOLB | |
| Hydrochloric Acid SCHEMBL7358813 | 0.83 | F2 (0.52) | ALDH1A1F2GAATSHRPOLB | |
| SCHEMBL7351436 | 0.82 | F2 (0.44) | ALDH1A1F2FNTAFNTBPGGT1B | |
| SCHEMBL6634947 | 0.82 | F2 (0.54) | ALDH1A1F2FNTAFNTBPGGT1B | |
| SCHEMBL8026776 | 0.80 | F2 (0.49) | ALDH1A1F2FNTAFNTBPGGT1B | |
| SCHEMBL7359105 | 0.80 | F2 (0.65) | ALDH1A1F2POLBMAPTKDR | |
| SCHEMBL7358688 | 0.80 | PKLR (0.47) | ALDH1A1F2GAAEGLN1 | |
| SCHEMBL7355762 | 0.80 | HCRTR2 (0.36) | F2FNTAFNTBMAPTRORC | |
| SCHEMBL6635727 | 0.80 | F2 (0.49) | ALDH1A1F2FNTAFNTBPGGT1B |
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-1999028297-A1 | SUBSTITUTED INDOLES, HAVING A THROMBIN INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-06-10 | — | — | WO | disclosed |