Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.68 |
| ▸ | MAPT | P10636 | 4/20 | 0.61 |
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | PKM | P14618 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.56 |
| ▸ | TUBB | P07437 | 2/20 | 0.56 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.56 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.56 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.56 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.56 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.56 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.56 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.56 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL998483 | 1.00 | ABCG2 (0.68) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL997901 | 0.89 | MAPT (0.76) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL997900 | 0.89 | MAPT (0.76) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL998188 | 0.88 | ABCG2 (0.69) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL998186 | 0.88 | ABCG2 (0.69) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL998110 | 0.85 | ABCG2 (0.65) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL998114 | 0.85 | ABCG2 (0.65) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL997049 | 0.84 | ABCG2 (0.65) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL997048 | 0.84 | ABCG2 (0.65) | ABCG2MAPTNPC1RAB9AMEN1 | |
| SCHEMBL997226 | 0.83 | ABCG2 (0.69) | ABCG2MAPTNPC1RAB9AMEN1 |
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-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | disclosed |