Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.36 |
| ▸ | NTRK3 | Q16288 | 3/20 | 0.36 |
| ▸ | NTRK2 | Q16620 | 3/20 | 0.36 |
| ▸ | DAO | P14920 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.35 |
| ▸ | IGF1R | P08069 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8067268 | 0.89 | ALDH1A1 (0.56) | ALDH1A1MEN1KMT2ANTRK1NTRK3 | |
| SCHEMBL8069285 | 0.84 | ALDH1A1 (0.34) | ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL8073685 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2ANTRK1NTRK3 | |
| SCHEMBL8392328 | 0.81 | KDM5A (0.37) | ALDH1A1NTRK1NTRK3NTRK2KDM5A | |
| SCHEMBL8071853 | 0.80 | ALDH1A1 (0.54) | ALDH1A1MEN1KMT2ADAOHPGD | |
| Emivirine SCHEMBL4657810 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2ADAOHPGD | |
| Emivirine SCHEMBL140546 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2ADAOHPGD | |
| SCHEMBL1687617 | 0.78 | KDM5A (0.33) | NTRK1NTRK3NTRK2HPGDKDM5A | |
| SCHEMBL8431027 | 0.77 | ALDH1A1 (0.42) | ALDH1A1MEN1KMT2ADAOHPGD | |
| SCHEMBL8068304 | 0.76 | ALDH1A1 (0.39) | ALDH1A1HPGDPOLBKDM4EMAPT |
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-6136815-A | VIRICIDES FOR TREATMENT OF AIDS | KOREA RESEARCH INST. OF CHEM. TECH. (KR) | 2000-10-24 | — | — | US | disclosed |