Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.46 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10316187 | 0.81 | SMO (0.45) | SMOCXCR3NPC1RAB9ALMNA | |
| SCHEMBL10316205 | 0.76 | SMO (0.49) | SMO | |
| SCHEMBL10004581 | 0.75 | SMO (0.49) | SMONPC1RAB9ALMNAMEN1 | |
| SCHEMBL3426735 | 0.75 | SMO (0.49) | SMONPC1RAB9ALMNAMEN1 | |
| SCHEMBL16230004 | 0.75 | SMO (0.47) | SMO | |
| SCHEMBL16230014 | 0.74 | SMO (0.55) | SMO | |
| SCHEMBL1056839 | 0.74 | KMT2A (0.49) | SMONPC1RAB9ALMNAGAA | |
| SCHEMBL10004405 | 0.74 | KMT2A (0.49) | SMONPC1RAB9ALMNAGAA | |
| SCHEMBL10004809 | 0.74 | SMO (0.47) | SMOGAAMEN1KMT2A | |
| SCHEMBL16230003 | 0.73 | SMO (0.52) | SMO |
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-2471791-B1 | FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2014-11-12 | — | — | EP | disclosed |