Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3812133 | 0.90 | RAB9A (0.35) | RAB9ANPC1ALDH1A1GAAMAPT | |
| SCHEMBL3807325 | 0.89 | NPC1 (0.47) | HSD17B1HSD17B2RAB9ANPC1PTGES | |
| SCHEMBL3809719 | 0.86 | KMT2A (0.39) | RAB9ANPC1ALDH1A1GAAMAPT | |
| SCHEMBL2878959 | 0.86 | TSHR (0.40) | RAB9ANPC1ALDH1A1GAAMAPT | |
| SCHEMBL3810045 | 0.85 | PTGER1 (0.35) | RAB9ANPC1KMT2ATAS2R14 | |
| SCHEMBL2157942 | 0.85 | — | — | |
| SCHEMBL3807176 | 0.85 | RAB9A (0.36) | RAB9ANPC1ALDH1A1GAAMAPT | |
| SCHEMBL3808900 | 0.84 | ALDH1A1 (0.42) | RAB9ANPC1ALDH1A1GAAMAPT | |
| SCHEMBL3809793 | 0.84 | NPC1 (0.41) | RAB9ANPC1ALDH1A1PTGESALOX5 | |
| SCHEMBL3817127 | 0.83 | MEN1 (0.44) | RAB9ANPC1ALDH1A1GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1401825-B1 | THIOPHENE DERIVATIVES AS ANTIVIRAL AGENTS FOR FLAVIVIRUS INFECTION | VIROCHEM PHARMA INC (CA) | 2009-08-05 | — | — | EP | claimed |