Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6682014 | 0.90 | ALDH1A1 (0.59) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL6677485 | 0.77 | ALDH1A1 (0.53) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL6683070 | 0.77 | KMT2A (0.54) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL6678678 | 0.77 | ADORA3 (0.60) | KDM4EALDH1A1HPGDSMN1; SMN2MAPT | |
| SCHEMBL5335198 | 0.74 | RAB9A (0.73) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL6683539 | 0.72 | ADORA3 (0.54) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL6680339 | 0.69 | ADORA3 (0.66) | KDM4EALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL9313091 | 0.68 | ALDH1A1 (0.71) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL29111414 | 0.68 | MTNR1A (0.65) | ALDH1A1HPGDNPC1RAB9AMAPT | |
| SCHEMBL6681714 | 0.68 | ADORA3 (0.61) | KDM4EALDH1A1HPGDSMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004043951-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | CAREX S.A. (FR) | 2004-05-27 | — | — | WO | disclosed |