Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | GUSB | P08236 | 2/20 | 0.39 |
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13680977 | 0.82 | CA12 (0.40) | NPC1MAPTPRKDCCA12CA1 | |
| SCHEMBL13680983 | 0.80 | CDK8 (0.46) | BRD4APP | |
| SCHEMBL13680976 | 0.77 | MAPT (0.50) | MAPT | |
| SCHEMBL13680971 | 0.74 | TERT (0.44) | NPC1MAPTBRD4 | |
| SCHEMBL13681029 | 0.73 | ALDH1A1 (0.36) | MAPT | |
| SCHEMBL28228401 | 0.73 | CYP2A6 (0.51) | NPC1CYP2A6MAPTCYP17A1CYP11B1 | |
| SCHEMBL13680986 | 0.73 | GUSB (0.45) | NPC1PSMB8CYP2A6MAPTGUSB | |
| SCHEMBL13680470 | 0.72 | NPC1 (0.50) | NPC1PSMB8CYP2A6PRKDCCASP3 | |
| SCHEMBL17214988 | 0.72 | NPC1 (0.50) | NPC1PSMB8CYP2A6PRKDCCASP3 | |
| SCHEMBL13680864 | 0.72 | ALDH1A1 (0.63) | NPC1MAPT |
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-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |