Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | STAT6 | P42226 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 7/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL364652 | 0.90 | CA2 (0.40) | IDO1EGFRMAPTALDH1A1KDM4E | |
| SCHEMBL367746 | 0.86 | EGFR (0.43) | IDO1PTGS2EGFRMAPTALDH1A1 | |
| SCHEMBL365426 | 0.85 | MAPT (0.47) | IDO1MAPTALDH1A1KDM4EMEN1 | |
| SCHEMBL366461 | 0.84 | HTT (0.46) | IDO1PTGS2EGFRMAPTALDH1A1 | |
| SCHEMBL365146 | 0.82 | IDO1 (0.40) | IDO1PTGS2EGFRMAPTALDH1A1 | |
| SCHEMBL366103 | 0.82 | ALDH1A1 (0.60) | IDO1CYP1A2CYP3A4HIF1AMAPT | |
| SCHEMBL366810 | 0.79 | PTGS2 (0.45) | IDO1PTGS2EGFRCYP3A4MAPT | |
| SCHEMBL365934 | 0.79 | KDM4E (0.45) | IDO1PTGS2EGFRMAPTALDH1A1 | |
| SCHEMBL366887 | 0.79 | KDM4E (0.56) | IDO1PTGS2EGFRMAPTALDH1A1 | |
| SCHEMBL366132 | 0.78 | ALDH1A1 (0.38) | IDO1PTGS2EGFRCYP1A2MAPT |
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 |