Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL3817190 | 0.87 | NTRK1 (0.43) | KDM4EHSD17B1HSD17B2GAAL3MBTL1 | |
| SCHEMBL3816846 | 0.86 | IKBKB (0.38) | IKBKBTP53KDM4EHSD17B1HSD17B2 | |
| SCHEMBL2158487 | 0.84 | IKBKB (0.45) | IKBKBTP53KDM4EADORA3ADORA2A | |
| SCHEMBL3808987 | 0.83 | HSD17B1 (0.39) | HSD17B1HSD17B2MAPTGAARAB9A | |
| SCHEMBL3817235 | 0.81 | HSD17B1 (0.45) | HSD17B1HSD17B2MAPTGAARAB9A | |
| SCHEMBL3812673 | 0.81 | GPBAR1 (0.41) | HSD17B1HSD17B2 | |
| SCHEMBL3807569 | 0.81 | HSD17B1 (0.45) | HSD17B1HSD17B2POLBKMT2A | |
| SCHEMBL3809712 | 0.81 | POLB (0.50) | TP53KDM4EHSD17B1HSD17B2MAPT | |
| SCHEMBL3812250 | 0.81 | HPGD (0.41) | HSD17B1HSD17B2MAPTPOLBCHEK1 | |
| SCHEMBL3807286 | 0.80 | CYP1A2 (0.41) | POLB |
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 |