Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18964398 | 0.88 | KDM4E (0.40) | KDM4EHTR2AHTR2CNFE2L2GAA | |
| SCHEMBL18909761 | 0.87 | USP2 (0.39) | KDM4EHTR2AHTR2CTAS1R3TAS1R1 | |
| SCHEMBL18909760 | 0.86 | KCNH2 (0.39) | KDM4EHTR2AHTR2CTAS1R3TAS1R1 | |
| SCHEMBL19361586 | 0.85 | KDM4E (0.38) | KDM4EHTR2AHTR2CNFE2L2GAA | |
| SCHEMBL18909753 | 0.85 | TAS1R3 (0.39) | KDM4EHTR2AHTR2CTAS1R3TAS1R1 | |
| SCHEMBL21231883 | 0.85 | PGR (0.40) | KDM4EHTR2AHTR2CTAS1R3TAS1R1 | |
| SCHEMBL18907016 | 0.85 | TAS1R3 (0.39) | KDM4EHTR2AHTR2CTAS1R3TAS1R1 | |
| SCHEMBL18909763 | 0.85 | TAS1R3 (0.39) | KDM4EHTR2AHTR2CTAS1R3TAS1R1 | |
| SCHEMBL18959741 | 0.84 | KDM4E (0.38) | KDM4EHTR2AHTR2CNFE2L2GAA | |
| SCHEMBL18914634 | 0.84 | KDM4E (0.38) | KDM4EHTR2AHTR2CTAS1R3TAS1R1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017091602-A1 | ESTER ACC INHIBITORS AND USES THEREOF | GILEAD APOLLO, LLC (US) | 2017-06-01 | — | — | WO | disclosed |
| WO-2017091600-A1 | PYRAZOLE ACC INHIBITORS AND USES THEREOF | GILEAD APOLLO, LLC (US) | 2017-06-01 | — | — | WO | disclosed |