Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.42 |
| ▸ | RHEB | Q15382 | 1/20 | 0.40 |
| ▸ | MAP2K2 | P36507 | 2/20 | 0.39 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.36 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5317194 | 0.85 | TUBB4A (0.42) | CYP1A2CYP2C19RAB9ALMNAALDH1A1 | |
| SCHEMBL30548745 | 0.76 | MAP2K2 (0.48) | HAO1RHEBMAP2K2MAP2K1CYP1A2 | |
| SCHEMBL30832956 | 0.73 | LMNA (0.57) | HAO1MAP2K2MAP2K1CYP1A2LMNA | |
| SCHEMBL761802 | 0.73 | LMNA (0.57) | HAO1MAP2K2MAP2K1CYP1A2LMNA | |
| SCHEMBL5608977 | 0.73 | CYP2A6 (0.44) | CYP1A2RAB9ASMN1; SMN2ALDH1A1HSD17B10 | |
| SCHEMBL8514538 | 0.69 | MAP2K2 (0.43) | HAO1MAP2K2MAP2K1NPC1CYP1A2 | |
| SCHEMBL5087465 | 0.69 | MAP2K2 (0.65) | HAO1RHEBMAP2K2MAP2K1LMNA | |
| SCHEMBL28241888 | 0.69 | TUBB4A (0.67) | HAO1RHEBMAP2K2MAP2K1TYMS | |
| SCHEMBL23783712 | 0.68 | LMNA (0.49) | HAO1RHEBMAP2K2MAP2K1LMNA | |
| SCHEMBL20222312 | 0.68 | MAP2K2 (0.42) | HAO1RHEBMAP2K2MAP2K1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2065053-A1 | CELL DEATH INHIBITOR | Takeda Pharmaceutical Company Limited (JP) | 2009-06-03 | — | — | EP | disclosed |
| EP-1897880-A1 | 1,3-BENZOTHIAZINONE DERIVATIVE AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2008-03-12 | — | — | EP | disclosed |