Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FADS1 | O60427 | 1/20 | 0.48 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | NSD2 | O96028 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | BRS3 | P32247 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2350272 | 0.79 | FADS1 (0.43) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL5691101 | 0.70 | PDPK1 (0.53) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL783904 | 0.69 | PFKFB3 (0.49) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL2476603 | 0.69 | CYP3A4 (0.46) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL782435 | 0.69 | FADS1 (0.55) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL20511289 | 0.69 | FADS1 (0.55) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL26614814 | 0.69 | FADS1 (0.51) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL26614621 | 0.69 | FADS1 (0.51) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL26614619 | 0.69 | FADS1 (0.51) | FADS1PDPK1CYP3A4NSD2KDM4E | |
| SCHEMBL782718 | 0.68 | PFKFB3 (0.53) | FADS1PDPK1MAOAMAOBPFKFB3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2049491-B1 | HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF E1 ACTIVATING ENZYMES | MILLENNIUM PHARM INC (US) | 2010-10-20 | — | — | EP | disclosed |