Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | STS | P08842 | 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 | |
|---|---|---|---|---|
| SCHEMBL366809 | 0.87 | EGFR (0.39) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL365694 | 0.86 | TSHR (0.36) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL367015 | 0.86 | ALDH1A1 (0.50) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL366392 | 0.84 | PSEN1 (0.46) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL367540 | 0.82 | PSEN1 (0.45) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL366945 | 0.80 | EGFR (0.46) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL366321 | 0.80 | NR4A2 (0.40) | TSHRMAPK1LMNAL3MBTL1KDM4E | |
| SCHEMBL366765 | 0.79 | TSHR (0.48) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL366158 | 0.79 | KDM4E (0.43) | MAPK1CYP3A4ALDH1A1LMNATDP1 | |
| SCHEMBL365894 | 0.78 | TSHR (0.48) | TSHRMAPK1TP53CYP3A4ALDH1A1 |
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-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |