Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TYMS | P04818 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | TDP2 | O95551 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CASP6 | P55212 | 2/20 | 0.37 |
| ▸ | SAE1 | Q9UBE0 | 2/20 | 0.37 |
| ▸ | UBA2 | Q9UBT2 | 2/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27788304 | 0.82 | THRB (0.42) | ALDH1A1TDP1CYP3A4HPGDHSD17B10 | |
| SCHEMBL27788241 | 0.78 | TYMS (0.47) | ALDH1A1TDP1CYP3A4HPGDTSHR | |
| SCHEMBL13888391 | 0.77 | GAA (0.41) | ALDH1A1TDP1CYP3A4HPGDTSHR | |
| SCHEMBL27766890 | 0.75 | TYMS (0.41) | ALDH1A1TDP1CYP3A4HPGDTSHR | |
| SCHEMBL27766739 | 0.74 | THRB (0.40) | ALDH1A1TDP1CYP3A4HPGDTSHR | |
| SCHEMBL27788393 | 0.74 | CYP19A1 (0.37) | ALDH1A1TDP1CYP3A4HPGDHSD17B10 | |
| SCHEMBL28780920 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TDP1CYP3A4HPGDTSHR | |
| SCHEMBL421454 | 0.72 | KMT2A (0.56) | ALDH1A1TDP1CYP3A4HPGDHSD17B10 | |
| SCHEMBL27828818 | 0.71 | CYP3A4 (0.47) | ALDH1A1TDP1CYP3A4HPGDHSD17B10 | |
| SCHEMBL11850804 | 0.71 | THRB (0.48) | ALDH1A1TDP1CYP3A4HPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-101617251-A | Blooming | SUMITOMO CHEMICAL CO | 2009-12-30 | — | — | CN | disclosed |