Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 8/20 | 0.43 |
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16664909 | 0.85 | CYP1A2 (0.43) | FAAHTSHRCYP1A2CYP2C19CYP3A4 | |
| SCHEMBL16664949 | 0.76 | FLT3 (0.39) | FAAHTSHRCYP1A2CYP2C19CYP3A4 | |
| SCHEMBL16664979 | 0.76 | FAAH (0.39) | FAAHTSHRCYP1A2CYP2C19CYP3A4 | |
| SCHEMBL16665010 | 0.76 | FAAH (0.41) | FAAHCYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL18627048 | 0.74 | ABL1 (0.44) | FAAHTSHRCYP1A2CYP2C19CYP3A4 | |
| SCHEMBL15473168 | 0.74 | FAAH (0.43) | FAAHTSHRCYP1A2CYP2C19CYP3A4 | |
| SCHEMBL19819911 | 0.73 | HPGDS (0.37) | TSHRCYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL16664919 | 0.72 | PIK3CA (0.44) | FAAHCYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL16664969 | 0.72 | KDM4E (0.47) | FAAHCYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL15473146 | 0.72 | CYP1A2 (0.36) | FAAHTSHRCYP1A2CYP2C19CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015058031-A1 | DNA-PK INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-04-23 | — | — | WO | disclosed |