Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 12/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 10/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.41 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.41 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.41 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.41 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.41 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.41 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL7467777 | 0.80 | CYP2A6 (0.46) | PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3 | |
| SCHEMBL4608811 | 0.79 | METAP2 (0.33) | — | |
| SCHEMBL9769412 | 0.76 | HSD17B1 (0.44) | HSD17B1HSD17B2CYP3A4CYP2C9PRKAB2 | |
| SCHEMBL8309137 | 0.76 | PRKAB2 (0.45) | CYP3A4CYP2C9PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL4284888 | 0.74 | HSD17B1 (0.45) | HSD17B1HSD17B2CYP3A4CYP2C9TSHR | |
| SCHEMBL28293144 | 0.73 | TSHR (0.54) | HSD17B1HSD17B2CYP3A4CYP2C9PRKAB2 | |
| SCHEMBL11615997 | 0.72 | FGFR1 (0.33) | TSHRCYP1A2LMNA | |
| SCHEMBL1030907 | 0.72 | CYP2A6 (0.58) | HSD17B1HSD17B2CYP3A4CYP2C9TSHR | |
| SCHEMBL4275992 | 0.70 | HSD17B1 (0.50) | HSD17B1HSD17B2CYP3A4CYP2C9TSHR | |
| SCHEMBL16720625 | 0.70 | HSD17B1 (0.45) | HSD17B1HSD17B2CYP3A4CYP2C9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20090176307-A1 | Compounds, Compositions and Methods | CYTOKINETICS, INC. | 2009-07-09 | — | — | US | disclosed |