Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | AGPAT2 | O15120 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.36 |
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3406468 | 0.90 | KCNH2 (0.42) | NPC1RAB9AKCNH2DOT1LCYP1A2 | |
| SCHEMBL3410450 | 0.89 | NPC1 (0.38) | NPC1RAB9AKCNH2DOT1LCYP1A2 | |
| SCHEMBL3412873 | 0.89 | KCNH2 (0.45) | NPC1RAB9AKCNH2SCN9AMAPK1 | |
| SCHEMBL3413137 | 0.88 | CHRNA7 (0.40) | NPC1RAB9AKCNH2SCN9ASCN5A | |
| SCHEMBL3413260 | 0.88 | GAK (0.39) | NPC1RAB9AKCNH2SCN9AMAPK1 | |
| SCHEMBL3406068 | 0.87 | NPC1 (0.46) | NPC1RAB9AKCNH2TSHRDOT1L | |
| SCHEMBL3410260 | 0.84 | NPC1 (0.53) | NPC1RAB9AKCNH2MAPK1DOT1L | |
| SCHEMBL3410439 | 0.84 | SCN9A (0.41) | AGPAT2SCN9A | |
| SCHEMBL3407955 | 0.84 | NPC1 (0.51) | NPC1RAB9AKCNH2DOT1LBRD4 | |
| SCHEMBL3410139 | 0.83 | EGFR (0.46) | NPC1RAB9AKCNH2SCN9ASCN5A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2257541-A1 | MODULATORS FOR AMYLOID BETA | F. Hoffmann-La Roche AG (CH) | 2010-12-08 | — | — | EP | disclosed |
| WO-2009103652-A1 | MODULATORS FOR AMYLOID BETA | F. HOFFMANN-LA ROCHE AG (CH) | 2009-08-27 | — | — | WO | disclosed |