Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | KMO | O15229 | 1/20 | 0.57 |
| ▸ | MMP2 | P08253 | 1/20 | 0.56 |
| ▸ | MMP13 | P45452 | 1/20 | 0.56 |
| ▸ | MMP14 | P50281 | 1/20 | 0.56 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.52 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28143431 | 0.85 | KMO (0.61) | ALDH1A1MAPTKMOMKNK1MKNK2 | |
| SCHEMBL1895643 | 0.85 | CYP2C9 (0.57) | ALDH1A1MAPTCYP2C9CYP2C19KMO | |
| SCHEMBL15557036 | 0.84 | CYP2C9 (0.55) | CYP2C9CYP2C19CYP1A2NPC1RAB9A | |
| SCHEMBL17089048 | 0.84 | KMO (0.77) | ALDH1A1MAPTKMOMKNK1MKNK2 | |
| SCHEMBL29503876 | 0.84 | KMO (0.77) | ALDH1A1MAPTKMOMKNK1MKNK2 | |
| SCHEMBL10028690 | 0.84 | ALDH1A1 (0.56) | ALDH1A1MAPTCYP2C9CYP2C19KMO | |
| SCHEMBL5735824 | 0.82 | MKNK1 (0.59) | ALDH1A1MAPTCYP2C9CYP2C19MMP2 | |
| SCHEMBL10028699 | 0.81 | KMO (0.77) | ALDH1A1MAPTKMOMKNK1MKNK2 | |
| SCHEMBL14395132 | 0.80 | KMO (0.67) | ALDH1A1KMOMKNK1MKNK2KDM4E | |
| SCHEMBL3510029 | 0.80 | RAB9A (0.57) | ALDH1A1MAPTCYP2C9CYP2C19KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008119773-A1 | AMIDE DERIVATIVES AS INHIBITORS OF ASPARTYL PROTEASES | MEDIVIR AB (SE) | 2008-10-09 | — | — | WO | disclosed |