Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.36 |
| ▸ | CDK1 | P06493 | 3/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.36 |
| ▸ | GSK3A | P49840 | 3/20 | 0.36 |
| ▸ | GSK3B | P49841 | 3/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.36 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | CCR8 | P51685 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10293912 | 0.87 | HSP90AA1 (0.46) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL11790193 | 0.78 | HSP90AA1 (0.43) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL21297747 | 0.78 | HSP90AA1 (0.43) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL10303887 | 0.72 | NPC1 (0.36) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL21593097 | 0.72 | MASP2 (0.40) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL14597264 | 0.72 | L3MBTL1 (0.36) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL22595352 | 0.71 | ADRA2A (0.32) | — | |
| SCHEMBL9976522 | 0.71 | NPC1 (0.39) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL21398475 | 0.69 | NPC1 (0.33) | NPC1HSP90AA1L3MBTL1CCNB2CDK1 | |
| SCHEMBL23482474 | 0.67 | L3MBTL1 (0.58) | NPC1HSP90AA1L3MBTL1CCR1CCR5 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170237011-A1 | PICENE DERIVATIVE, PHOTOELECTRIC MATERIAL, AND PHOTOELECTRIC DEVICE | ADEKA CORPORATION (JP) | 2017-08-17 | — | — | US | disclosed |