Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 5/20 | 0.37 |
| ▸ | IDO1 | P14902 | 3/20 | 0.37 |
| ▸ | HTR6 | P50406 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.36 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL364605 | 0.90 | HTR6 (0.37) | ALDH1A1KDM4EHSD17B10AGTR1IDO1 | |
| SCHEMBL365521 | 0.88 | KMT2A (0.43) | ALDH1A1KDM4EHSD17B10IDO1MEN1 | |
| SCHEMBL366692 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KDM4EHSD17B10IDO1HTR6 | |
| SCHEMBL366461 | 0.83 | HTT (0.46) | ALDH1A1KDM4EAGTR1IDO1MEN1 | |
| SCHEMBL366133 | 0.82 | AGTR1 (0.41) | AGTR1HTR6HTR1ADRD2HTR1D | |
| SCHEMBL367746 | 0.81 | EGFR (0.43) | ALDH1A1KDM4EAGTR1IDO1MEN1 | |
| SCHEMBL365647 | 0.78 | IDO1 (0.43) | ALDH1A1KDM4EAGTR1IDO1MEN1 | |
| SCHEMBL366857 | 0.75 | ALDH1A1 (0.44) | ALDH1A1KDM4EHSD17B10IDO1MEN1 | |
| SCHEMBL366535 | 0.75 | EGFR (0.48) | ALDH1A1KDM4EHSD17B10IDO1MAPT | |
| SCHEMBL365146 | 0.74 | IDO1 (0.40) | ALDH1A1KDM4EAGTR1IDO1MEN1 |
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 3 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 |
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |