Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 9/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4637702 | 0.88 | PTGER4 (0.44) | CYP19A1PTGER4IDH1ALDH1A1GRIN1 | |
| SCHEMBL4637975 | 0.87 | CYP19A1 (0.39) | CYP19A1PTGER4IDH1ALDH1A1GRIN1 | |
| SCHEMBL4637971 | 0.86 | CYP19A1 (0.50) | CYP19A1CYP1A2SMN1; SMN2IDH1CYP11B1 | |
| SCHEMBL4638568 | 0.85 | IDH1 (0.54) | CYP19A1CYP1A2SMN1; SMN2PTGER4IDH1 | |
| SCHEMBL4637730 | 0.83 | MAPT (0.50) | CYP19A1CYP1A2SMN1; SMN2PTGER4IDH1 | |
| SCHEMBL4637999 | 0.83 | IDH1 (0.46) | CYP19A1CYP1A2SMN1; SMN2FGFR1IDH1 | |
| SCHEMBL4638905 | 0.77 | IDH1 (0.41) | CYP19A1SMN1; SMN2PTGER4IDH1ALDH1A1 | |
| SCHEMBL4637961 | 0.77 | CFTR (0.46) | CYP19A1SMN1; SMN2IDH1CYP11B1CYP11B2 | |
| SCHEMBL4637833 | 0.74 | CYP19A1 (0.59) | CYP19A1SMN1; SMN2IDH1GABRA1ALDH1A1 | |
| SCHEMBL23294412 | 0.73 | MEN1 (0.49) | CYP19A1CYP1A2SMN1; SMN2ALDH1A1GRIN1 |
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-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |