Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4A | O75164 | 1/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL365894 | 0.96 | TSHR (0.48) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL365400 | 0.91 | ELANE (0.47) | TSHRALDH1A1LMNAKDM4EHPGD | |
| SCHEMBL364761 | 0.86 | KDM4E (0.52) | TSHRMAPK1CYP3A4ALDH1A1LMNA | |
| SCHEMBL366408 | 0.83 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDL3MBTL1TDP1 | |
| SCHEMBL366754 | 0.82 | TSHR (0.45) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL366764 | 0.81 | ALDH1A1 (0.50) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL366392 | 0.81 | PSEN1 (0.46) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL364931 | 0.79 | NR4A2 (0.50) | CYP3A4ALDH1A1LMNAKDM4EHSD17B10 | |
| SCHEMBL367016 | 0.79 | TSHR (0.42) | TSHRMAPK1TP53CYP3A4ALDH1A1 | |
| SCHEMBL365562 | 0.78 | CYP3A4 (0.46) | TSHRTP53CYP3A4ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |