Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 6/20 | 0.52 |
| ▸ | RAB9A | P51151 | 6/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.48 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4875133 | 1.00 | MAPT (0.52) | MAPTSMN1; SMN2HTTALDH1A1GAA | |
| SCHEMBL749776 | 0.85 | MAPT (0.66) | MAPTSMN1; SMN2HTTALDH1A1GAA | |
| SCHEMBL7839551 | 0.84 | HTT (0.60) | MAPTSMN1; SMN2HTTGAANPC1 | |
| SCHEMBL14156906 | 0.82 | CA1 (0.69) | MAPTSMN1; SMN2ALDH1A1GAAALOX15 | |
| SCHEMBL6386624 | 0.82 | SRD5A2 (0.57) | MAPTSMN1; SMN2HTTALDH1A1GAA | |
| SCHEMBL7165400 | 0.82 | TSHR (0.66) | MAPTSMN1; SMN2ALDH1A1TSHRNPC1 | |
| SCHEMBL7832348 | 0.82 | NPC1 (0.65) | MAPTSMN1; SMN2ALDH1A1TSHRNPC1 | |
| SCHEMBL25244126 | 0.81 | NPC1 (0.68) | MAPTSMN1; SMN2ALDH1A1GAANPC1 | |
| SCHEMBL14157088 | 0.81 | CA1 (0.70) | MAPTSMN1; SMN2HTTALDH1A1NPC1 | |
| SCHEMBL7160001 | 0.81 | MEN1 (0.68) | MAPTSMN1; SMN2HTTNPC1RAB9A |
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-0739340-A1 | PHENYL HETEROCYCLES AS COX-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1996-10-30 | — | — | EP | disclosed |