Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3668129 | 0.74 | SLC6A2 (0.37) | MAPK1 | |
| Hydrochloric Acid SCHEMBL3670802 | 0.74 | SIGMAR1 (0.44) | CYP2D6ALDH1A1 | |
| SCHEMBL2844111 | 0.70 | HTT (0.42) | HTTCYP3A4MAPTMAPK9TRPM8 | |
| SCHEMBL7779209 | 0.70 | KDM4E (0.61) | TAAR1CYP3A4CYP2D6CYP2C19MAPK1 | |
| SCHEMBL4093709 | 0.68 | TLR9 (0.47) | HTTCYP3A4MAPTTRPM8CYP2D6 | |
| SCHEMBL6707313 | 0.68 | TLR9 (0.46) | HTTCYP3A4MAPTTRPM8CYP2D6 | |
| SCHEMBL3675727 | 0.68 | ALDH1A1 (0.41) | HTTTAAR1CYP3A4MAPTCYP2D6 | |
| SCHEMBL7122892 | 0.67 | HTT (0.44) | HTTCYP3A4MAPTMAPK9TRPM8 | |
| SCHEMBL7001948 | 0.67 | HTT (0.44) | HTTCYP3A4MAPTMAPK9TRPM8 | |
| SCHEMBL9867136 | 0.66 | ALDH1A1 (0.42) | HTTTAAR1CYP3A4MAPTMAPK9 |
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-2139461-A2 | AMINO DERIVATIVES TO PREVENT NEPHROTOXICITY AND CANCER | Recepticon Aps (DK) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008113364-A2 | AMINO DERIVATIVES TO PREVENT NEPHROTOXICITY AND CANCER | RECEPTICON APS (DK) | 2008-09-25 | — | — | WO | disclosed |