Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SCN1A | P35498 | 3/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6015765 | 0.93 | PHLPP2 (0.51) | GAAALDH1A1PHLPP2MAPK1MAPT | |
| SCHEMBL5542394 | 0.86 | ESR1 (0.54) | ALDH1A1MAPK1MAPTESR1LMNA | |
| SCHEMBL5539416 | 0.85 | ESR1 (0.50) | ALDH1A1MAPK1MAPTESR1LMNA | |
| SCHEMBL5535885 | 0.84 | ALDH1A1 (0.52) | ALDH1A1MAPK1MAPTESR1LMNA | |
| SCHEMBL5536597 | 0.83 | ALDH1A1 (0.49) | ALDH1A1MAPK1ESR1LMNACYP1A2 | |
| SCHEMBL5540470 | 0.80 | CA12 (0.50) | ALDH1A1MAPK1HSD17B10MAPTESR1 | |
| SCHEMBL6015708 | 0.78 | KDM4E (0.55) | ALDH1A1HSD17B10KDM4ERAB9AKMT2A | |
| SCHEMBL9629064 | 0.77 | GAA (0.84) | GAAALDH1A1PHLPP2MAPK1HSD17B10 | |
| SCHEMBL6015768 | 0.77 | KDM4E (0.47) | ALDH1A1MAOAHRH3HTR1AKDM4E | |
| SCHEMBL27601533 | 0.76 | ESR1 (0.38) | ALDH1A1MAPK1HSD17B10MAPTESR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7049312-B1 | Benzothiazinone and benzoxazinone compounds | ABBOTT GMBH & CO. KG (DE) | 2006-05-23 | — | — | US | claimed |
| CN-1636005-A | Benzothiazinone and benzoxazinone compounds | KNOLL AG (DE) | 2005-07-06 | — | — | CN | claimed |
| US-7049312-B1 | Benzothiazinone and benzoxazinone compounds | ABBOTT GMBH & CO. KG (DE) | 2006-05-23 | — | — | US | disclosed |
| CN-1636005-A | Benzothiazinone and benzoxazinone compounds | KNOLL AG (DE) | 2005-07-06 | — | — | CN | disclosed |