Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.56 |
| ▸ | CA9 | Q16790 | 2/20 | 0.56 |
| ▸ | LIMK2 | P53671 | 9/20 | 0.53 |
| ▸ | LIMK1 | P53667 | 6/20 | 0.53 |
| ▸ | ABL1 | P00519 | 1/20 | 0.52 |
| ▸ | LCK | P06239 | 1/20 | 0.52 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | GHSR | Q92847 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17913044 | 0.90 | LIMK2 (0.58) | LIMK2PRMT1KMT2AALDH1A1PKM | |
| SCHEMBL17913045 | 0.90 | LIMK2 (0.58) | LIMK2PRMT1KMT2AALDH1A1PKM | |
| SCHEMBL17913048 | 0.84 | ALOX12 (0.67) | CA12CA9LIMK2LIMK1MEN1 | |
| SCHEMBL17913066 | 0.78 | LIMK2 (0.60) | LIMK2MEN1KMT2AALDH1A1PKM | |
| SCHEMBL17913087 | 0.77 | CA12 (0.69) | CA12CA9LIMK2LIMK1ABL1 | |
| SCHEMBL17913091 | 0.77 | TDP1 (0.67) | CA12CA9MEN1KMT2AALDH1A1 | |
| SCHEMBL17913094 | 0.74 | LIMK2 (0.54) | CA12CA9LIMK2LIMK1ABL1 | |
| SCHEMBL17913041 | 0.74 | ALDH1A1 (0.57) | CA12CA9MEN1KMT2AALDH1A1 | |
| SCHEMBL17913065 | 0.74 | MAPT (0.63) | CA12CA9MEN1KMT2AALDH1A1 | |
| SCHEMBL17913056 | 0.74 | LMNA (0.62) | CA12CA9MEN1KMT2AALDH1A1 |
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 | disclosed |