Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28067351 | 0.88 | ALDH1A1 (0.61) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL8893316 | 0.85 | TSHR (0.59) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL29000969 | 0.84 | ALDH1A1 (0.70) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL9453026 | 0.84 | ALDH1A1 (0.70) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL28270647 | 0.82 | ALDH1A1 (0.68) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL3387460 | 0.81 | TSHR (0.69) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL27676643 | 0.81 | ALDH1A1 (0.65) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL27941784 | 0.81 | ALDH1A1 (0.47) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| SCHEMBL18473273 | 0.80 | TSHR (0.79) | TSHRCYP3A4MAPK1TP53ALDH1A1 | |
| Benzophenone SCHEMBL27409790 | 0.80 | ALDH1A1 (0.82) | TSHRCYP3A4MAPK1TP53ALDH1A1 |
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-2008060844-A1 | POLYMERIZATION INHIBITOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE | ALBEMARLE CORPORATION (US) | 2008-05-22 | — | — | WO | disclosed |