Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 14/20 | 0.54 |
| ▸ | RAB9A | P51151 | 14/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 7/20 | 0.47 |
| ▸ | RECQL | P46063 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13183599 | 0.83 | NPC1 (0.51) | NPC1RAB9AKMT2APKMMAPT | |
| SCHEMBL8212269 | 0.80 | KDM4E (0.49) | NPC1RAB9AKMT2APKMMAPT | |
| SCHEMBL720834 | 0.80 | NPC1 (0.43) | NPC1RAB9AKMT2APKMMAPT | |
| SCHEMBL54820 | 0.79 | ABCG2 (0.50) | NPC1RAB9AKMT2APKMMAPT | |
| SCHEMBL15597058 | 0.78 | NPC1 (0.39) | NPC1RAB9APKMMAPTRECQL | |
| SCHEMBL24723976 | 0.77 | NPC1 (0.47) | NPC1RAB9AKMT2APKMMAPT | |
| SCHEMBL8212317 | 0.77 | NPC1 (0.51) | NPC1RAB9AKMT2APKMMAPT | |
| SCHEMBL5193636 | 0.77 | HTT (0.53) | NPC1RAB9AKMT2AMAPTKDM4E | |
| SCHEMBL8214069 | 0.77 | ABCG2 (0.39) | NPC1RAB9APKMMAPTRECQL | |
| SCHEMBL18883090 | 0.76 | CYP1A2 (0.39) | NPC1RAB9AKMT2APKMMAPT |
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-2534170-B1 | IAP BIR DOMAIN BINDING COMPOUNDS | PHARMASCIENCE INC (CA) | 2017-04-19 | — | — | EP | disclosed |