Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 3/20 | 0.37 |
| ▸ | MYC | P01106 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | HEXA | P06865 | 1/20 | 0.35 |
| ▸ | HEXB | P07686 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAP2 | P11137 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12505699 | 0.82 | CES1 (0.42) | CYP11B1CYP11B2CES1KDM4EHTT | |
| SCHEMBL16057538 | 0.67 | MAPT (0.40) | KDM4EBRD4HSD17B10ALDH1A1MAPT | |
| SCHEMBL12505693 | 0.66 | BRD4 (0.46) | CES1KDM4ESMN1; SMN2TACR1BRD4 | |
| SCHEMBL10877381 | 0.65 | CES1 (0.42) | CYP11B1CYP11B2CES1KDM4EHTT | |
| SCHEMBL16057208 | 0.64 | SLC37A4 (0.38) | KDM4EMYCALDH1A1MAPTHPGD | |
| SCHEMBL7335823 | 0.63 | CES1 (0.66) | CES1KDM4EHTTSMN1; SMN2ELANE | |
| SCHEMBL2997057 | 0.63 | NOTUM (0.65) | CYP11B1CYP11B2GAA | |
| SCHEMBL30452280 | 0.63 | NOTUM (0.65) | CYP11B1CYP11B2GAA | |
| SCHEMBL1133067 | 0.62 | MYC (0.56) | SMN1; SMN2MYCHEXAHEXBALDH1A1 | |
| SCHEMBL16057503 | 0.62 | MCL1 (0.42) | BRD4 |
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-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |