Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | IKBKB | O14920 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4641330 | 0.74 | HDAC8 (0.35) | — | |
| SCHEMBL4961626 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL8940635 | 0.63 | NPC1 (0.68) | NPC1RAB9AFFAR1 | |
| SCHEMBL11245121 | 0.62 | ALDH1A1 (0.57) | NPC1RAB9A | |
| SCHEMBL13805579 | 0.60 | HTR2C (0.55) | NPC1RAB9APTPN1 | |
| SCHEMBL30937310 | 0.60 | ALDH1A1 (0.50) | PTPN1 | |
| SCHEMBL4641291 | 0.59 | COXFA4 (0.44) | — | |
| SCHEMBL6029391 | 0.59 | ALDH1A1 (0.52) | NPC1RAB9A | |
| SCHEMBL2540273 | 0.58 | PARP1 (0.46) | — | |
| SCHEMBL311565 | 0.58 | PARP1 (0.46) | — |
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-1956016-A1 | Bicyclic acyltryptophanols | Bayer Schering Pharma Aktiengesellschaft (DE) | 2008-08-13 | — | — | EP | disclosed |