Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ANO1 | Q5XXA6 | 9/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6526431 | 0.82 | HTT (0.47) | CA1CA2MEN1KMT2AMAPK1 | |
| SCHEMBL4341826 | 0.79 | HSPA5 (0.46) | MEN1KMT2AMAPK1HTTPOLB | |
| SCHEMBL6566791 | 0.79 | POLB (0.46) | CA1CA2MEN1KMT2AHTT | |
| SCHEMBL6568667 | 0.77 | CA1 (0.56) | CA1CA2MEN1KMT2AMAPK1 | |
| SCHEMBL6567257 | 0.75 | NPC1 (0.41) | CA1CA2MEN1KMT2AMAPK1 | |
| SCHEMBL4346954 | 0.74 | KMT2A (0.40) | CA1CA2MEN1KMT2AMAPK1 | |
| SCHEMBL4347164 | 0.74 | KMT2A (0.53) | CA1CA2MEN1KMT2AMAPK1 | |
| SCHEMBL6567229 | 0.74 | CA2 (0.74) | CA1CA2ANO1L3MBTL1HPGD | |
| SCHEMBL4341979 | 0.72 | POLB (0.54) | MEN1KMT2AHTTPOLBMAPT | |
| SCHEMBL6673594 | 0.71 | MEN1 (0.48) | CA1CA2MEN1KMT2AMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |