Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 6/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18529823 | 0.93 | MAOB (0.43) | STSHSP90AA1HSP90AB1CA12CA1 | |
| SCHEMBL30785086 | 0.87 | STS (0.50) | STSHSP90AA1HSP90AB1ALDH1A1CYP1A2 | |
| SCHEMBL18529878 | 0.85 | CA12 (0.38) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL18540604 | 0.83 | CA12 (0.36) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL2989104 | 0.81 | AKR1C3 (0.53) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL341880 | 0.81 | KMT2A (0.53) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL5188852 | 0.81 | MAPT (0.55) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL2676116 | 0.80 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1CA12CA1CA9 | |
| SCHEMBL5155346 | 0.80 | AKR1C2 (0.44) | ALDH1A1 | |
| SCHEMBL5156418 | 0.80 | AKR1C2 (0.44) | — |
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-2017030983-A1 | COMPOSITIONS AND METHODS FOR INHIBITION OF CATHEPSINS | MATEON THERAPEUTICS, INC. (US) | 2017-02-23 | — | — | WO | disclosed |