Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | BRD4 | O60885 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 7/20 | 0.53 |
| ▸ | RAB9A | P51151 | 7/20 | 0.53 |
| ▸ | MEN1 | O00255 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2221594 | 0.88 | NPC1 (0.64) | MAPTCYP1A2CYP2C19LMNATP53 | |
| SCHEMBL2230480 | 0.87 | MAPT (0.58) | MAPTCYP1A2CYP3A4CYP2C19LMNA | |
| SCHEMBL12515816 | 0.83 | HPSE (0.59) | MAPTLMNANPC1RAB9AMEN1 | |
| SCHEMBL12519327 | 0.83 | NPC1 (0.54) | MAPTLMNANPC1RAB9AMEN1 | |
| SCHEMBL12519558 | 0.80 | MEN1 (0.51) | MAPTLMNATP53NPC1RAB9A | |
| SCHEMBL12519402 | 0.79 | HTT (0.66) | MAPTCYP1A2CYP3A4CYP2C19LMNA | |
| SCHEMBL17225238 | 0.79 | RAB9A (0.67) | MAPTCYP1A2CYP2C19LMNATP53 | |
| SCHEMBL1764786 | 0.79 | MAPT (0.70) | MAPTLMNABRD4TP53NPC1 | |
| SCHEMBL2739996 | 0.78 | MAPT (0.66) | MAPTCYP1A2CYP3A4CYP2C19LMNA | |
| SCHEMBL12519404 | 0.78 | HTT (0.64) | MAPTCYP1A2CYP3A4CYP2C19LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011085261-A1 | HEDGEHOG INHIBITORS | SELEXAGEN THERAPEUTICS, INC. (US) | 2011-07-14 | — | — | WO | disclosed |
| WO-2011085261-A1 | HEDGEHOG INHIBITORS | SELEXAGEN THERAPEUTICS, INC. (US) | 2011-07-14 | — | — | WO | disclosed |