Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.53 |
| ▸ | CA9 | Q16790 | 3/20 | 0.53 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.52 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.46 |
| ▸ | FURIN | P09958 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | LIMK2 | P53671 | 5/20 | 0.45 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | IL1RN | P18510 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17913071 | 0.92 | CA12 (0.48) | CA12CA9TMPRSS6F2F10 | |
| SCHEMBL17913104 | 0.92 | CA12 (0.48) | CA12CA9TMPRSS6F2F10 | |
| SCHEMBL17913098 | 0.91 | ALDH1A1 (0.47) | CA12CA9TMPRSS6F2F10 | |
| SCHEMBL17913068 | 0.91 | PGR (0.49) | CA12CA9TMPRSS6ALDH1A1KMT2A | |
| SCHEMBL17913094 | 0.79 | LIMK2 (0.54) | CA12CA9TMPRSS6LIMK2LIMK1 | |
| SCHEMBL17913087 | 0.78 | CA12 (0.69) | CA12CA9TMPRSS6F2F10 | |
| SCHEMBL17913041 | 0.72 | ALDH1A1 (0.57) | CA12CA9TMPRSS6ALDH1A1KMT2A | |
| SCHEMBL5452240 | 0.71 | TMPRSS6 (0.73) | CA12CA9TMPRSS6ALDH1A1KMT2A | |
| SCHEMBL17913100 | 0.71 | CA12 (1.00) | CA12CA9TMPRSS6ALDH1A1KMT2A | |
| SCHEMBL8176346 | 0.70 | TMPRSS6 (1.00) | CA12CA9TMPRSS6F2ALDH1A1 |
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-2016111658-A1 | SYNTHESIS OF THIOSEMICARBAZONE DERIVATIVES COMPRISING SULPHONAMIDE GROUP WITH POTENTIAL ANTICONVULSANT ACTIVITY | IYIDOGAN AYSEGUL (TR) | 2016-07-14 | — | — | WO | claimed |