Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10333808 | 1.00 | GABRR1 (0.41) | GABRR1TSHRPPARDMAPTMAPK1 | |
| SCHEMBL9617956 | 1.00 | GABRR1 (0.41) | GABRR1TSHRPPARDMAPTMAPK1 | |
| SCHEMBL9252059 | 0.82 | TSHR (0.38) | TSHRPPARDMAPTTP53TDP1 | |
| SCHEMBL8734587 | 0.79 | TSHR (0.41) | TSHRPPARDMAPTMAPK1TP53 | |
| SCHEMBL28358348 | 0.79 | TSHR (0.41) | TSHRPPARDMAPTMAPK1TP53 | |
| SCHEMBL16982316 | 0.78 | TSHR (0.40) | TSHRPPARDMAPTMAPK1TP53 | |
| SCHEMBL2458072 | 0.74 | TSHR (0.48) | TSHRPPARDMAPTTP53TDP1 | |
| SCHEMBL9617948 | 0.71 | TSHR (0.38) | TSHRPPARD | |
| SCHEMBL9192007 | 0.71 | GABRR1 (0.50) | GABRR1TSHRTDP1 | |
| SCHEMBL9192010 | 0.71 | GABRR1 (0.50) | GABRR1TSHRTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4077491-A | — | — | None | — | — | JP | disclosed |
| JP-H0477491-A | FLUORINE-CONTAINING AMIDE COMPOUND AND ITS PREPARATION | SUMITOMO CHEM CO LTD | 1992-03-11 | — | — | JP | disclosed |
| US-4902835-A | Fluorinated butene derivatives and methods for their preparation | THE UNIVERSITY OF ROCHESTER (US) | 1990-02-20 | — | — | US | disclosed |