Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | PRKCI | P41743 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | VCP | P55072 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12441324 | 0.80 | NAPRT (0.50) | MAPTCYP1A2CYP3A4CYP2D6MAPK1 | |
| SCHEMBL13460683 | 0.77 | NAPRT (0.53) | MAPTCYP1A2CYP3A4CYP2D6MAPK1 | |
| SCHEMBL181049 | 0.74 | ALDH1A1 (0.60) | MAPTNAPRTBRD4HTTALDH1A1 | |
| SCHEMBL14227406 | 0.73 | NAPRT (0.54) | NAPRTPRKCIP2RX7ALDH1A1KDM4E | |
| SCHEMBL13545172 | 0.72 | NAPRT (0.61) | MAPTCYP3A4NAPRTPRKCIP2RX7 | |
| Hydrochloric Acid SCHEMBL27738327 | 0.71 | NAPRT (0.59) | MAPTCYP3A4NAPRTPRKCIP2RX7 | |
| SCHEMBL9368829 | 0.70 | NAPRT (0.62) | MAPTCYP3A4NAPRTPRKCIP2RX7 | |
| SCHEMBL2301544 | 0.69 | HTT (0.45) | MAPTCYP1A2CYP3A4CYP2D6MAPK1 | |
| SCHEMBL2301534 | 0.69 | HTT (0.45) | MAPTCYP1A2CYP3A4CYP2D6MAPK1 | |
| SCHEMBL29686396 | 0.69 | PRKCI (0.55) | NAPRTPRKCIP2RX7HTTALDH1A1 |
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-2020247804-A1 | HETEROCYCLE SUBSTITUTED PYRIDINE DERIVATIVE ANTIFUNGAL AGENTS | AMPLYX PHARMACEUTICALS, INC. (US) | 2020-12-10 | — | — | WO | disclosed |