Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 7/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12820420 | 0.95 | POLB (0.44) | MAPK1GAAALDH1A1NPC1RAB9A | |
| SCHEMBL13783322 | 0.91 | MAPK1 (0.53) | MAPK1GAAALDH1A1NPC1RAB9A | |
| SCHEMBL20159607 | 0.87 | L3MBTL1 (0.51) | MAPK1GAAALDH1A1NPC1RAB9A | |
| SCHEMBL24424685 | 0.84 | EPHX2 (0.48) | MAPK1GAAALDH1A1NPC1RAB9A | |
| SCHEMBL23583243 | 0.84 | MAPK1 (0.63) | MAPK1GAAALDH1A1NPC1RAB9A | |
| SCHEMBL24423522 | 0.84 | MAPK1 (0.63) | MAPK1GAAALDH1A1NPC1RAB9A | |
| SCHEMBL13746318 | 0.84 | GAA (0.61) | MAPK1GAAALDH1A1EPHX2L3MBTL1 | |
| SCHEMBL10265288 | 0.83 | POLB (0.53) | MAPK1GAAALDH1A1RAB9AEPHX2 | |
| SCHEMBL13745743 | 0.82 | GAA (0.64) | MAPK1GAAALDH1A1EPHX2L3MBTL1 | |
| SCHEMBL8257182 | 0.82 | GAA (0.64) | MAPK1GAAALDH1A1EPHX2L3MBTL1 |
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-2012126084-A1 | HSP-90 BINDING COMPOUNDS, COMPOSITIONS THEREOF, AND THEIR USE IΝ THE TREATMENT AND PREVENTION OF FUNGAL INFECTIONS | PHARMASCIENCE INC. (CA) | 2012-09-27 | — | — | WO | disclosed |