Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | CDK4 | P11802 | 8/20 | 0.42 |
| ▸ | CCND1 | P24385 | 8/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | MOK | Q9UQ07 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1733586 | 0.87 | KDM4E (0.53) | KDM4ECDK4CCND1CDK2HTR1A | |
| SCHEMBL1734451 | 0.81 | KDM4E (0.69) | KDM4EMAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL1733607 | 0.73 | KDM4E (1.00) | KDM4EMAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL1733450 | 0.70 | KDM4E (0.64) | KDM4EALDH1A1 | |
| SCHEMBL1734567 | 0.70 | KDM4E (0.78) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL1733742 | 0.69 | KDM4E (0.85) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL1733611 | 0.68 | KDM4E (0.83) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL1733590 | 0.68 | HTR1A (0.48) | CDK4CCND1MEN1KMT2AALDH1A1 | |
| SCHEMBL1734118 | 0.67 | KDM4E (0.66) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL1733610 | 0.67 | KDM4E (0.81) | KDM4EMEN1KMT2AALDH1A1SMN1; 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-1891018-B1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMA (US) | 2011-11-16 | — | — | EP | claimed |
| WO-2011131686-A1 | A THERMALLY CONTROLLED ASSEMBLY | NAPATECH A/S (DK) | 2011-10-27 | — | — | WO | claimed |