Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | GLS | O94925 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14679453 | 0.95 | NPC1 (0.56) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14679421 | 0.89 | NPC1 (0.58) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14679158 | 0.87 | NPC1 (0.53) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14679450 | 0.86 | NPC1 (0.52) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14679159 | 0.85 | NPC1 (0.54) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14679419 | 0.83 | KDM4E (0.57) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14679160 | 0.82 | NPC1 (0.57) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL14679372 | 0.81 | MAPT (0.56) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL13753360 | 0.80 | NPC1 (0.61) | NPC1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL30598810 | 0.80 | NPC1 (0.61) | NPC1MEN1KMT2AALDH1A1HPGD |
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-8367668-B2 | Pyridazinone derivatives | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 2013-02-05 | — | — | US | disclosed |