Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH5 | P11766 | 1/20 | 0.78 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.78 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | POLB | P06746 | 5/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL244680 | 0.94 | ADH5 (0.78) | ADH5CYP2C19NPC1MAPTPOLB | |
| SCHEMBL245647 | 0.92 | ADH5 (0.75) | ADH5CYP2C19NPC1MAPTPOLB | |
| N6022 SCHEMBL244480 | 0.88 | ADH5 (1.00) | ADH5CYP2C19NPC1MAPTPOLB | |
| N6022 SCHEMBL29502874 | 0.88 | ADH5 (1.00) | ADH5CYP2C19NPC1MAPTPOLB | |
| SCHEMBL248012 | 0.86 | ADH5 (0.80) | ADH5CYP2C19NPC1MAPTPOLB | |
| SCHEMBL1977561 | 0.85 | ADH5 (0.70) | ADH5CYP2C19NPC1MAPTPOLB | |
| SCHEMBL242214 | 0.84 | ADH5 (0.72) | ADH5CYP2C19NPC1MAPTPOLB | |
| SCHEMBL244176 | 0.84 | ADH5 (0.74) | ADH5CYP2C19NPC1MAPTPOLB | |
| SCHEMBL244325 | 0.84 | ADH5 (0.69) | ADH5CYP2C19NPC1MAPTPOLB | |
| SCHEMBL243641 | 0.84 | ADH5 (0.75) | ADH5CYP2C19NPC1MAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2318006-B1 | NOVEL PYRROLE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE AS THERAPEUTIC AGENTS | NIVALIS THERAPEUTICS INC (US) | 2016-10-12 | — | — | EP | claimed |