Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 8/20 | 0.49 |
| ▸ | NPC1 | O15118 | 7/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.48 |
| ▸ | RELA | Q04206 | 2/20 | 0.48 |
| ▸ | WDR5 | P61964 | 1/20 | 0.48 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL19529676 | 0.81 | ALDH1A3 (0.53) | ALDH1A3RAB9ANPC1KDM4EPKM | |
| SCHEMBL28186684 | 0.79 | TLR8 (0.61) | ALDH1A3RAB9ANPC1KDM4EPKM | |
| SCHEMBL10983496 | 0.79 | PTGS1 (0.46) | RAB9ANPC1KDM4EPKMSMN1; SMN2 | |
| SCHEMBL258720 | 0.76 | PDE10A (0.49) | ALDH1A3RAB9ANPC1KDM4EPKM | |
| Bromide SCHEMBL10012835 | 0.74 | RAB9A (0.50) | ALDH1A3RAB9ANPC1KDM4EPKM | |
| SCHEMBL30098806 | 0.73 | CASP3 (0.50) | ALDH1A3RAB9ANPC1KDM4ESMN1; SMN2 | |
| SCHEMBL11671335 | 0.72 | CASP3 (0.49) | ALDH1A3RAB9ANPC1KDM4EPKM | |
| SCHEMBL30149969 | 0.69 | PDE3B (0.57) | ALDH1A3RAB9ANPC1KDM4EPKM | |
| SCHEMBL2947512 | 0.69 | MAPT (0.62) | ALDH1A3RAB9ANPC1KDM4EPKM | |
| SCHEMBL9704213 | 0.68 | EGFR (0.60) | ALDH1A3RAB9ANPC1KDM4EPKM |
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-1373217-A1 | 2-MERCAPTO-4,5-DIARYLIMIDAZOLE DERIVATIVES AND THE USE THEREOF AS CYCLOOXYGENASE INHIBITORS | Beiersdorf AG (DE) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002076951-A1 | 2-MERCAPTO-4,5-DIARYLIMIDAZOLE DERIVATIVES AND THE USE THEREOF AS CYCLOOXYGENASE INHIBITORS | BEIERSDORF AG (DE) | 2002-10-03 | — | — | WO | disclosed |