Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 5/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL570033 | 0.84 | MEN1 (0.50) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL3409048 | 0.81 | MEN1 (0.40) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL25381545 | 0.79 | TDP1 (0.46) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL1222348 | 0.79 | TDP1 (0.49) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL16379307 | 0.79 | MEN1 (0.46) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL3166361 | 0.79 | TDP1 (0.49) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL1222350 | 0.79 | TDP1 (0.49) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL13960156 | 0.79 | MEN1 (0.46) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL5352030 | 0.79 | MEN1 (0.46) | MEN1GAAKMT2ATDP1CA12 | |
| SCHEMBL2369074 | 0.79 | MEN1 (0.46) | MEN1GAAKMT2ATDP1CA12 |
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-2004112709-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-12-29 | — | — | WO | disclosed |