Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.48 |
| ▸ | RAB9A | P51151 | 7/20 | 0.48 |
| ▸ | HTT | P42858 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 11/20 | 0.44 |
| ▸ | POLB | P06746 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 9/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28427470 | 1.00 | NPC1 (0.48) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL31649431 | 0.86 | POLB (0.46) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL31649308 | 0.86 | KMT2A (0.43) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL31649237 | 0.83 | NPC1 (0.58) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL31649420 | 0.80 | POLB (0.49) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL23759743 | 0.77 | NPC1 (0.52) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL10593941 | 0.76 | RAB9A (0.71) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL10593944 | 0.76 | RAB9A (0.71) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL19076241 | 0.75 | NPC1 (0.59) | NPC1RAB9AHTTSMN1; SMN2MAPT | |
| SCHEMBL4394015 | 0.75 | ALDH1A1 (0.49) | NPC1RAB9AHTTSMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-106117188-B | Compounds for the treatment of cancer | 台北科技大学 | 2020-07-17 | — | — | CN | disclosed |