Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | PLG | P00747 | 1/20 | 0.45 |
| ▸ | PLAU | P00749 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | HCK | P08631 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 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 | |
|---|---|---|---|---|
| SCHEMBL27620200 | 0.81 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL3433878 | 0.76 | CYP2A6 (0.58) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL23538286 | 0.72 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL6016015 | 0.72 | ALDH1A1 (0.53) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL6015941 | 0.71 | MEN1 (0.47) | ALDH1A1KDM4ECYP2A6MEN1KMT2A | |
| SCHEMBL29954469 | 0.70 | ALDH1A1 (1.00) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL671759 | 0.70 | ALDH1A1 (1.00) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL29935657 | 0.68 | PIM3 (0.65) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL16067285 | 0.68 | CYP2A6 (0.64) | ALDH1A1KDM4EMAPTCYP2A6PLG | |
| SCHEMBL1049957 | 0.68 | PIM3 (0.65) | ALDH1A1KDM4EMAPTCYP2A6PLG |
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 |
|---|---|---|---|---|---|---|---|
| CN-1636005-A | Benzothiazinone and benzoxazinone compounds | KNOLL AG (DE) | 2005-07-06 | — | — | CN | disclosed |