Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ESRRG | P62508 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6567229 | 0.83 | CA2 (0.74) | CA1CA2KDM4EHPGDL3MBTL1 | |
| SCHEMBL4709488 | 0.77 | PCNA (0.46) | CA1CA2KDM4EHPGDESRRG | |
| SCHEMBL4344564 | 0.75 | HTT (0.53) | KDM4EHPGDL3MBTL1POLBANO1 | |
| SCHEMBL10001184 | 0.74 | ESRRG (0.44) | CA1CA2KDM4EHPGDESRRG | |
| SCHEMBL31117181 | 0.74 | POLB (0.60) | KDM4EHPGDL3MBTL1POLBALDH1A1 | |
| SCHEMBL4351873 | 0.72 | POLB (0.38) | KDM4EHPGDESRRGPOLBALDH1A1 | |
| SCHEMBL5702050 | 0.72 | GAA (0.46) | CA2KDM4EHPGDESRRGPOLB | |
| SCHEMBL26422576 | 0.71 | HPGD (0.66) | HPGDESRRGTRPV1 | |
| SCHEMBL926809 | 0.71 | GAA (0.66) | KDM4EHPGDL3MBTL1POLBALDH1A1 | |
| SCHEMBL30154442 | 0.71 | GAA (0.66) | KDM4EHPGDL3MBTL1POLBALDH1A1 |
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 |