Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.40 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31582154 | 0.79 | ALDH1A1 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL16360980 | 0.79 | MEN1 (0.66) | MAPTTSHRSLC22A6SLC22A8MEN1 | |
| SCHEMBL4613376 | 0.78 | KDM4C (0.57) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10379610 | 0.77 | KLF10 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4614884 | 0.77 | KLF10 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL997660 | 0.77 | MAPT (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29070029 | 0.77 | CA1 (0.69) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10796669 | 0.76 | HAO1 (0.46) | MAPTTSHRESR2RAB9ALMNA | |
| SCHEMBL31582156 | 0.74 | AGTR1 (0.48) | CA12CA1CA2CA9MAPT | |
| SCHEMBL10651124 | 0.74 | PKM (0.55) | CA12CA1CA2CA7CA9 |
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-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | disclosed |