Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 3/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.38 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CTSV | O60911 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL3807325 | 0.92 | NPC1 (0.47) | PTGESALOX5NPC1RAB9ALTC4S | |
| SCHEMBL3809793 | 0.91 | NPC1 (0.41) | PTGESALOX5NPC1RAB9AKMT2A | |
| SCHEMBL3809833 | 0.88 | PTGES (0.56) | PTGESALOX5NPC1RAB9ALTC4S | |
| SCHEMBL3816654 | 0.87 | PTGES (0.42) | PTGESALOX5NPC1RAB9ALTC4S | |
| SCHEMBL2157707 | 0.86 | PTGES (0.45) | PTGESALOX5NPC1RAB9ALTC4S | |
| SCHEMBL3809468 | 0.86 | HDAC6 (0.43) | PTGESALOX5NPC1RAB9ATRPM8 | |
| SCHEMBL3815202 | 0.86 | HSD17B1 (0.39) | KMT2AHSD17B1HSD17B2TAS2R14TP53 | |
| SCHEMBL3812133 | 0.85 | RAB9A (0.35) | PTGESALOX5NPC1RAB9AKMT2A | |
| SCHEMBL3814755 | 0.84 | AOC3 (0.40) | NPC1RAB9AKMT2AHSD17B1HSD17B2 | |
| SCHEMBL2878959 | 0.84 | TSHR (0.40) | NPC1RAB9AKMT2ATP53 |
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 |