Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.63 |
| ▸ | MEN1 | O00255 | 3/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.63 |
| ▸ | DRD3 | P35462 | 1/20 | 0.63 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11217214 | 0.84 | KMT2A (0.48) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL23979141 | 0.83 | CYP3A4 (0.47) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL17056905 | 0.83 | TSHR (0.53) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL28154597 | 0.78 | KMT2A (0.49) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL27712795 | 0.78 | HSP90AB1 (0.47) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| Flopropione SCHEMBL26316 | 0.77 | CYP3A4 (1.00) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL8239577 | 0.76 | FEN1 (0.57) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL7300081 | 0.76 | MEN1 (0.65) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL28155500 | 0.76 | CYP3A4 (0.65) | CYP3A4MEN1KMT2APTGS1DRD3 | |
| SCHEMBL16284311 | 0.74 | CYP3A4 (0.63) | CYP3A4MEN1KMT2APTGS1DRD3 |
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-2015129926-A1 | PYRAZOLE AMIDE DERIVATIVE | TEIJIN PHARMA LIMITED (JP) | 2015-09-03 | — | — | WO | disclosed |