Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1H | O95180 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 6/20 | 0.39 |
| ▸ | LSS | P48449 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9876697 | 0.86 | LSS (0.43) | CACNA1HKDM4ESMN1; SMN2CACNA1BLSS | |
| SCHEMBL9234584 | 0.86 | LSS (0.46) | KDM4ESMN1; SMN2LSSBCHEACHE | |
| SCHEMBL9877732 | 0.85 | ALDH1A1 (0.53) | KDM4ESMN1; SMN2CACNA1BLSSALDH1A1 | |
| SCHEMBL9879836 | 0.83 | LSS (0.41) | CACNA1HKDM4ECACNA1BLSSROCK2 | |
| SCHEMBL9876979 | 0.83 | GAA (0.48) | KDM4ESMN1; SMN2LSSALDH1A1HPGD | |
| Fumaric Acid SCHEMBL10591933 | 0.81 | LSS (0.41) | KDM4ESMN1; SMN2LSSBCHEACHE | |
| SCHEMBL9234490 | 0.81 | GSK3B (0.50) | KDM4ESMN1; SMN2ALOX5LSSCYP3A4 | |
| SCHEMBL9876891 | 0.81 | LSS (0.44) | KDM4ESMN1; SMN2LSSBCHEACHE | |
| Fumaric Acid SCHEMBL9237908 | 0.80 | ALDH1A1 (0.48) | KDM4ESMN1; SMN2LSSBCHEACHE | |
| Maleic Acid SCHEMBL9237900 | 0.80 | ALDH1A1 (0.48) | KDM4ESMN1; SMN2LSSBCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-5006520-A | Antibiotics, antitumor agents, treatment of blood disorders | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1991-04-09 | — | — | US | disclosed |