Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | ERN1 | O75460 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CASP6 | P55212 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | PRKDC | P78527 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11284187 | 0.88 | ERN1 (0.56) | ALDH1A1ERN1TDP1TSHRCASP6 | |
| SCHEMBL9735773 | 0.83 | ALDH1A1 (0.69) | ALDH1A1TDP1TSHRCASP6CYP3A4 | |
| SCHEMBL9734521 | 0.81 | ALDH1A1 (0.67) | ALDH1A1TDP1TSHRCASP6CYP3A4 | |
| SCHEMBL579426 | 0.78 | ALDH1A1 (0.68) | ALDH1A1TDP1TSHRCASP6CYP3A4 | |
| SCHEMBL30696914 | 0.78 | ALDH1A1 (0.68) | ALDH1A1TDP1TSHRCASP6CYP3A4 | |
| SCHEMBL11211853 | 0.78 | ALDH1A1 (0.58) | ALDH1A1ERN1TDP1MAPTMEN1 | |
| SCHEMBL9669905 | 0.78 | ALDH1A1 (0.58) | ALDH1A1ERN1TDP1TSHRCASP6 | |
| SCHEMBL1394957 | 0.77 | TDP1 (0.69) | ALDH1A1ERN1TDP1CYP3A4MAPT | |
| SCHEMBL5167844 | 0.77 | ALDH1A1 (0.66) | ALDH1A1TDP1TSHRCASP6CYP3A4 | |
| SCHEMBL3164372 | 0.77 | ALDH1A1 (0.51) | ALDH1A1ERN1TDP1TSHRCASP6 |
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-0237434-B1 | SUBSTITUTED 2,3-NAPHTHALENEDICARBOXALDEHYDES | OREAD LABORATORIES, INC. (US) | 1991-12-04 | — | — | EP | disclosed |
| US-4723022-A | Substituted 2,3-naphthalenedicarboxaldehydes | OREAD LABORATORIES, INC. (US) | 1988-02-02 | — | — | US | disclosed |