Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 3/20 | 0.38 |
| ▸ | TOP2B | Q02880 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.32 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.30 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.30 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27520234 | 0.80 | NOTUM (0.37) | TOP2ATOP2BMEN1KMT2ANOTUM | |
| SCHEMBL6786216 | 0.78 | GSK3B (0.40) | TOP2ATOP2BKCNH2CACNA1FPOLB | |
| SCHEMBL5001847 | 0.78 | TOP2A (0.38) | TOP2ATOP2BMEN1KMT2ANOTUM | |
| SCHEMBL8120234 | 0.75 | MEN1 (0.36) | TOP2ATOP2BMEN1KMT2ASTAT3 | |
| SCHEMBL27408658 | 0.72 | ALDH1A1 (0.41) | TOP2ATOP2BMEN1KMT2AKCNH2 | |
| SCHEMBL27351360 | 0.72 | MEN1 (0.53) | MEN1KMT2AKCNH2HRH3CACNA1F | |
| SCHEMBL27322864 | 0.70 | MEN1 (0.36) | TOP2ATOP2BMEN1KMT2ASTAT3 | |
| SCHEMBL27610949 | 0.69 | STAT3 (0.36) | TOP2ATOP2BMEN1KMT2ASTAT3 | |
| SCHEMBL28069524 | 0.69 | TPMT (0.36) | MEN1KMT2AKCNH2POLBGSK3B | |
| SCHEMBL15598878 | 0.68 | CACNA1F (0.35) | TOP2ATOP2BKCNH2CACNA1FPOLB |
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-5493048-A | REACTING METALLIZED FLUORO-TRIFLUOROMETHYLBENZENE DERIVATIVE WITH CARBON DIOXIDE AND PRODUCT IS THEN HYDROLYSED WITH AN ACID TO FORM ACID, SIMILARLY HALOGENATION GIVE ACID HALIDE AND WITH ALCOHOL GIVES ESTER | BAYER AKTIENGESELLSCHAFT (DE) | 1996-02-20 | — | — | US | disclosed |