Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MGLL | Q99685 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20804235 | 0.85 | HSP90AA1 (0.43) | NPC1RAB9ACA12CA9SMN1; SMN2 | |
| SCHEMBL12189448 | 0.84 | SNCA (0.51) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL4017346 | 0.84 | NPC1 (0.65) | NPC1RAB9ACA12CA9KMT2A | |
| SCHEMBL20804153 | 0.83 | HSP90AA1 (0.48) | KMT2AMEN1HPGD | |
| SCHEMBL23252470 | 0.83 | NPC1 (0.58) | NPC1RAB9ACA12CA9KMT2A | |
| SCHEMBL10181786 | 0.83 | NPC1 (0.58) | NPC1RAB9ACA12CA9KMT2A | |
| SCHEMBL14562610 | 0.82 | NPC1 (0.61) | NPC1RAB9ACA12CA9KMT2A | |
| SCHEMBL19577474 | 0.81 | SMN1; SMN2 (0.56) | KMT2AMEN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL21872480 | 0.81 | NPC1 (0.56) | NPC1RAB9ACA12CA9KMT2A | |
| SCHEMBL21226256 | 0.80 | NPC1 (0.54) | NPC1RAB9ACA12CA9KMT2A |
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-2020100011-A1 | IMPROVED SYNTHETIC METHODS OF MAKING FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2020-05-22 | — | — | WO | disclosed |