Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.33 |
| ▸ | PMM2 | O15305 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9862074 | 0.71 | NPC1 (0.55) | NPC1RAB9AHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL9872899 | 0.63 | SMN1; SMN2 (0.55) | NPC1RAB9AHPGDSMN1; SMN2ALDH1A1 | |
| Formaldehyde SCHEMBL27861058 | 0.61 | NPC1 (0.87) | NPC1RAB9AHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL2424631 | 0.60 | NPC1 (0.96) | NPC1RAB9AHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL27925421 | 0.60 | NPC1 (0.43) | NPC1RAB9AHPGDSMN1; SMN2NPSR1 | |
| SCHEMBL29417850 | 0.60 | NPC1 (0.96) | NPC1RAB9AHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL30421152 | 0.59 | NPC1 (0.42) | NPC1RAB9AHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL6366734 | 0.59 | ALDH1A1 (0.41) | NPC1RAB9AHPGDALDH1A1NPSR1 | |
| SCHEMBL6272216 | 0.57 | SIGMAR1 (0.41) | NPC1RAB9AHPGDSMN1; SMN2NPSR1 | |
| SCHEMBL3029886 | 0.57 | SIGMAR1 (0.35) | NPC1RAB9AHPGDSMN1; SMN2ALDH1A1 |
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-0294647-B1 | THIADIAZINONES | MERCK PATENT GmbH (DE) | 1993-07-21 | — | — | EP | disclosed |