Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CDK4 | P11802 | 2/20 | 0.44 |
| ▸ | CCND1 | P24385 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | HAT1 | O14929 | 2/20 | 0.42 |
| ▸ | EP300 | Q09472 | 2/20 | 0.42 |
| ▸ | GPR18 | Q14330 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7780397 | 0.77 | NPC1 (0.46) | NPC1POLBRAB9ADRD2DRD3 | |
| SCHEMBL7804248 | 0.75 | PTGS2 (0.49) | NPC1POLBRAB9ADRD2DRD3 | |
| SCHEMBL7785268 | 0.73 | NPC1 (0.45) | NPC1POLBRAB9ADRD2DRD3 | |
| SCHEMBL7006163 | 0.73 | DRD2 (0.73) | NPC1POLBRAB9ADRD2DRD3 | |
| SCHEMBL7784939 | 0.72 | KMT2A (0.51) | NPC1POLBRAB9ADRD2DRD3 | |
| SCHEMBL7785217 | 0.70 | FAAH (0.51) | NPC1POLBRAB9ACDK2MAPT | |
| SCHEMBL13720170 | 0.69 | NPC1 (0.59) | NPC1POLBRAB9ADRD2DRD3 | |
| SCHEMBL6599683 | 0.67 | HTR2A (0.71) | NPC1POLBRAB9ADRD2MAPT | |
| SCHEMBL2947799 | 0.66 | KCNA5 (0.76) | MAPTKMT2AMEN1ALDH1A1GAA | |
| SCHEMBL11178183 | 0.66 | KMT2A (0.64) | NPC1POLBRAB9ADRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1070703-A1 | Cyclobutene derivatives | Sankyo Company Limited (JP) | 2001-01-24 | — | — | EP | disclosed |