Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | RORC | P51449 | 4/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MLYCD | O95822 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL365635 | 0.88 | IDO1 (0.44) | CES1HTTKDM4EIDO1HTR2A | |
| SCHEMBL365935 | 0.85 | KDM4E (0.47) | KDM4EAGTR1EGFRRORCSRC | |
| SCHEMBL367091 | 0.84 | KMT2A (0.44) | HTTKDM4EEGFRSRCALDH1A1 | |
| SCHEMBL366876 | 0.81 | EGFR (0.44) | KDM4EAGTR1EGFRRORCSRC | |
| SCHEMBL366811 | 0.81 | EGFR (0.44) | KDM4EAGTR1EGFRSRCALDH1A1 | |
| SCHEMBL366000 | 0.80 | ELANE (0.47) | HTTALDH1A1 | |
| SCHEMBL365000 | 0.78 | HTT (0.42) | CES1HTTKDM4EIDO1ALDH1A1 | |
| SCHEMBL365911 | 0.78 | CES1 (0.42) | CES1HTTKDM4EAGTR1IDO1 | |
| SCHEMBL367205 | 0.78 | EGFR (0.45) | KDM4EAGTR1EGFRRORCSRC | |
| SCHEMBL366371 | 0.78 | EGFR (0.45) | KDM4EAGTR1EGFRSRCALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |