Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.71 |
| ▸ | RAB9A | P51151 | 8/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.71 |
| ▸ | GAA | P10253 | 1/20 | 0.71 |
| ▸ | GCK | P35557 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | METAP2 | P50579 | 1/20 | 0.56 |
| ▸ | METAP1 | P53582 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL10930595 | 0.85 | NPC1 (0.69) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL24074621 | 0.83 | NPC1 (1.00) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL30339352 | 0.83 | NPC1 (1.00) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL12443375 | 0.81 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL2642588 | 0.80 | GCK (0.66) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL7514601 | 0.78 | GCK (1.00) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL3278951 | 0.76 | CYP1A2 (0.73) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL5206561 | 0.76 | CYP1A2 (1.00) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL2642573 | 0.75 | KDM4E (0.74) | NPC1RAB9AALDH1A1SMN1; SMN2GAA | |
| SCHEMBL11509919 | 0.75 | NPC1 (0.70) | NPC1RAB9AALDH1A1SMN1; SMN2GAA |
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-2004099127-A1 | NOVEL COMPOUNDS AS KINASE INHIBITORS | NOVO NORDISK A/S (DK) | 2004-11-18 | — | — | WO | disclosed |