Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5722486 | 0.92 | THRA (0.36) | ALDH1A1MAPK1HTTTHRATHRB | |
| SCHEMBL5722588 | 0.92 | ALDH1A1 (0.35) | ALDH1A1MAPK1HTTTHRBKMT2A | |
| SCHEMBL5722776 | 0.91 | THRB (0.38) | ALDH1A1MAPK1HTTTHRATHRB | |
| SCHEMBL5722833 | 0.90 | THRA (0.45) | ALDH1A1MAPK1HTTTHRATHRB | |
| SCHEMBL5717860 | 0.90 | KMT2A (0.33) | ALDH1A1MAPK1HTTTHRATHRB | |
| SCHEMBL5718237 | 0.89 | HSD17B10 (0.33) | ALDH1A1MAPK1HTTTHRBKMT2A | |
| SCHEMBL5722468 | 0.88 | KMT2A (0.40) | ALDH1A1MAPK1HTTTHRATHRB | |
| SCHEMBL5722508 | 0.88 | SMN1; SMN2 (0.37) | ALDH1A1MAPK1HTTTHRATHRB | |
| SCHEMBL5717864 | 0.87 | KMT2A (0.33) | ALDH1A1MAPK1HTTKMT2AMEN1 | |
| SCHEMBL5116899 | 0.87 | ALDH1A1 (0.39) | ALDH1A1MAPK1HTTTHRATHRB |
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-1732532-A1 | NOVEL PHARMACEUTICAL COMPOSITIONS COMPRISING AGONISTS OF THE THYROID RECEPTOR | KARO BIO AB (SE) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005092316-A1 | NOVEL PHARMACEUTICAL COMPOSITIONS COMPRISING AGONISTS OF THE THYROID RECEPTOR | KARO BIO AB (SE) | 2005-10-06 | — | — | WO | disclosed |