Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18833161 | 0.74 | AKT1 (0.39) | TSHRCYP2C19MAPTRECQLHSD17B10 | |
| SCHEMBL1415252 | 0.73 | TDP1 (0.62) | TSHRCYP2C19MAPTRECQLHSD17B10 | |
| SCHEMBL7567511 | 0.73 | TDP1 (0.62) | TSHRCYP2C19MAPTRECQLHSD17B10 | |
| SCHEMBL10497226 | 0.73 | TDP1 (0.62) | TSHRCYP2C19MAPTRECQLHSD17B10 | |
| SCHEMBL26391230 | 0.73 | AKT1 (0.38) | TSHRCYP2C19MAPTRECQLHSD17B10 | |
| SCHEMBL907405 | 0.72 | AKT1 (0.61) | CYP2C19MAPTRECQLTDP1CYP3A4 | |
| SCHEMBL5119838 | 0.72 | AKT1 (0.61) | CYP2C19MAPTRECQLTDP1CYP3A4 | |
| SCHEMBL9362014 | 0.72 | ALDH1A1 (0.41) | TSHRCYP2C19MAPTRECQLHSD17B10 | |
| SCHEMBL27463499 | 0.71 | AKR1C3 (0.40) | TSHRCYP2C19MAPTRECQLHSD17B10 | |
| SCHEMBL19658785 | 0.70 | AKT1 (0.35) | TSHRCYP2C19MAPTRECQLHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1167357-A1 | ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES | Sankyo Company, Limited (JP) | 2002-01-02 | — | — | EP | disclosed |