Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL6568498 | 0.85 | ALDH1A1 (0.54) | KMT2ANPC1RAB9AHPGDCYP1A2 | |
| SCHEMBL1948889 | 0.85 | NPC1 (0.69) | EPHX2KMT2ANPC1RAB9AHPGD | |
| SCHEMBL6565535 | 0.84 | ALDH1A1 (0.53) | KMT2ANPC1RAB9AHPGDCYP1A2 | |
| SCHEMBL1950761 | 0.83 | EPHX2 (0.72) | EPHX2KMT2ANPC1RAB9AHPGD | |
| SCHEMBL26279356 | 0.82 | EPHX2 (0.68) | EPHX2KMT2ANPC1RAB9AHPGD | |
| SCHEMBL29295104 | 0.79 | KMT2A (0.74) | EPHX2KMT2ANPC1RAB9AHPGD | |
| SCHEMBL4345960 | 0.78 | EPHX1 (0.64) | EPHX2KMT2ANPC1RAB9AHPGD | |
| SCHEMBL22808948 | 0.76 | RAB9A (0.71) | EPHX2KMT2ANPC1RAB9AHPGD | |
| SCHEMBL12931994 | 0.75 | EPHX2 (1.00) | EPHX2KMT2ANPC1RAB9AHPGD | |
| SCHEMBL6566838 | 0.75 | P2RX7 (0.53) | KMT2ANPC1RAB9AHPGDSMN1; SMN2 |
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 |