Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MMP2 | P08253 | 3/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 4/20 | 0.40 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.39 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3467601 | 0.88 | KMT2A (0.43) | KMT2AMMP2MMP13ESR1TAS2R14 | |
| SCHEMBL4014559 | 0.85 | LMNA (0.41) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL1856286 | 0.83 | KMT2A (0.40) | KMT2AMMP2MMP12MMP13ESR1 | |
| SCHEMBL4015138 | 0.78 | MMP2 (0.44) | MMP2MMP12MMP13TAS2R14LIMK2 | |
| SCHEMBL10728056 | 0.74 | CA12 (0.62) | KMT2ATAS2R14CA12CA9KEAP1 | |
| SCHEMBL1856837 | 0.74 | KMT2A (0.53) | KMT2AESR1TAS2R14CA12CA9 | |
| SCHEMBL4008265 | 0.74 | LMNA (0.41) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL1859337 | 0.72 | ESR1 (0.39) | KMT2AMMP2MMP13ESR1MEN1 | |
| SCHEMBL20183917 | 0.72 | LMNA (0.56) | KMT2AMEN1HTT | |
| SCHEMBL4014515 | 0.70 | PTGDR2 (0.41) | KMT2ATAS2R14MEN1CA12CA1 |
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-2009080722-A2 | CARBOXYLIC DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2009-07-02 | — | — | WO | disclosed |