Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2676116 | 0.86 | HSP90AA1 (0.41) | NPC1POLBRAB9AHSP90AA1HSP90AB1 | |
| SCHEMBL555801 | 0.86 | GSK3B (0.48) | NPC1POLBRAB9AHSP90AA1HSP90AB1 | |
| SCHEMBL28059870 | 0.83 | CTNNB1 (0.46) | NPC1RAB9ASMN1; SMN2TDP1HTT | |
| SCHEMBL4000875 | 0.82 | NR4A2 (0.46) | RAB9ASMN1; SMN2HSP90AA1HSP90AB1ALDH1A1 | |
| SCHEMBL15512384 | 0.82 | CES2 (0.45) | NPC1RAB9ASMN1; SMN2TDP1HTT | |
| SCHEMBL6314039 | 0.82 | ERCC5 (0.47) | NPC1RAB9ABLMSMN1; SMN2ALDH1A1 | |
| SCHEMBL4392887 | 0.81 | GSK3B (0.54) | ALDH1A1 | |
| SCHEMBL341880 | 0.81 | KMT2A (0.53) | NPC1RAB9ASMN1; SMN2HSP90AA1HSP90AB1 | |
| SCHEMBL2989104 | 0.81 | AKR1C3 (0.53) | NPC1POLBRAB9AHSP90AA1HSP90AB1 | |
| SCHEMBL1712501 | 0.81 | NPC1 (0.45) | NPC1POLBRAB9ASMN1; SMN2TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5219881-A | Enzyme inhibitors | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-06-15 | — | — | US | disclosed |
| US-5098932-A | Inhibitors of lipoxygenase for treatment of diseases mediated with leukotrienes | IMPERIAL CHEMICAL INDUSTRIES PLC, ICI PHARMA (FR) | 1992-03-24 | — | — | US | disclosed |