Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.59 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.59 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.56 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.52 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.52 |
| ▸ | DHODH | Q02127 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4353624 | 0.92 | P2RY1 (0.68) | EPHX1EPHX2S1PR2P2RY1MEN1 | |
| SCHEMBL4358553 | 0.88 | MEN1 (0.71) | EPHX1EPHX2P2RY1MEN1KMT2A | |
| SCHEMBL4342381 | 0.88 | KMT2A (0.68) | EPHX1EPHX2MEN1KMT2ANPC1 | |
| SCHEMBL1706750 | 0.84 | DHODH (0.54) | EPHX1EPHX2P2RY1MEN1KMT2A | |
| SCHEMBL30589617 | 0.84 | MEN1 (0.77) | P2RY1MEN1KMT2ANPC1LMNA | |
| SCHEMBL28563388 | 0.84 | MEN1 (0.77) | P2RY1MEN1KMT2ANPC1LMNA | |
| SCHEMBL28569445 | 0.84 | MAPT (0.60) | EPHX2MEN1KMT2ALMNAMAPT | |
| SCHEMBL11006451 | 0.83 | EPHX1 (0.61) | EPHX1EPHX2S1PR2P2RY1MEN1 | |
| SCHEMBL4350367 | 0.82 | HTT (0.62) | EPHX1EPHX2S1PR2P2RY1MEN1 | |
| SCHEMBL3668804 | 0.82 | CNR1 (0.61) | EPHX1EPHX2MEN1KMT2ANPC1 |
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 |