Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.43 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL17913040 | 0.92 | CA12 (0.53) | CA12CA9TMPRSS6ALDH1A1MEN1 | |
| SCHEMBL17913104 | 0.90 | CA12 (0.48) | CA12CA9TMPRSS6ALDH1A1MEN1 | |
| SCHEMBL17913098 | 0.88 | ALDH1A1 (0.47) | CA12CA9LMNATMPRSS6ALDH1A1 | |
| SCHEMBL17913068 | 0.88 | PGR (0.49) | CA12CA9LMNATDP1TMPRSS6 | |
| SCHEMBL17913056 | 0.75 | LMNA (0.62) | CA12CA9LMNATDP1ALDH1A1 | |
| SCHEMBL17913094 | 0.75 | LIMK2 (0.54) | CA12CA9TMPRSS6 | |
| SCHEMBL17913039 | 0.74 | MEN1 (0.56) | CA12CA9LMNATDP1ALDH1A1 | |
| SCHEMBL17913087 | 0.74 | CA12 (0.69) | CA12CA9TMPRSS6ALDH1A1MEN1 | |
| SCHEMBL7584032 | 0.72 | CES1 (0.81) | CA12CA9TDP1ALDH1A1MEN1 | |
| SCHEMBL7094386 | 0.71 | CES1 (0.69) | CA12CA9TDP1TMPRSS6ALDH1A1 |
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 |