Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 7/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.58 |
| ▸ | MAPT | P10636 | 6/20 | 0.58 |
| ▸ | RAB9A | P51151 | 5/20 | 0.58 |
| ▸ | GAA | P10253 | 4/20 | 0.58 |
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.55 |
| ▸ | VCP | P55072 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.54 |
| ▸ | RELA | Q04206 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3635139 | 0.91 | ALOX5 (0.69) | PTGS2MEN1KMT2AMAPTALOX5 | |
| SCHEMBL3641518 | 0.90 | PTGS2 (0.56) | PTGS2MEN1KMT2AMAPTRAB9A | |
| SCHEMBL3637592 | 0.89 | CSNK2A1 (0.53) | PTGS2MEN1KMT2AMAPTGAA | |
| SCHEMBL3634967 | 0.86 | ALOX5 (0.55) | PTGS2MEN1KMT2AMAPTRAB9A | |
| SCHEMBL3637805 | 0.85 | VCP (0.59) | PTGS2MEN1KMT2AMAPTGAA | |
| SCHEMBL3640999 | 0.83 | CYP1B1 (0.53) | PTGS2MEN1KMT2AMAPTRAB9A | |
| SCHEMBL3640612 | 0.83 | AMY1A (0.54) | PTGS2MAPTALOX5VCPALDH1A1 | |
| SCHEMBL3632755 | 0.83 | ALOX5 (0.53) | PTGS2MEN1KMT2AMAPTGAA | |
| SCHEMBL3633219 | 0.83 | PSEN1 (0.64) | PTGS2MEN1KMT2AMAPTGAA | |
| SCHEMBL1041244 | 0.83 | CYP1A1 (0.53) | PTGS2MEN1KMT2AMAPTRAB9A |
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-2155740-A1 | HETARYLANILINES AS MODULATORS FOR AMYLOID BETA | F. Hoffmann-Roche AG (CH) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008138753-A1 | HETARYLANILINES AS MODULATORS FOR AMYLOID BETA | F. HOFFMANN-LA ROCHE AG (CH) | 2008-11-20 | — | — | WO | disclosed |