Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.33 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2557909 | 0.76 | EPHX2 (0.56) | EPHX2ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL19014687 | 0.69 | ALDH1A1 (0.36) | ALDH1A1DRD3 | |
| SCHEMBL17033019 | 0.66 | ALDH1A1 (0.42) | ALDH1A1CASP3CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10881713 | 0.66 | CYP1A2 (0.40) | ALDH1A1PLIN1MAPTPLIN5ABHD5 | |
| SCHEMBL6662082 | 0.64 | ALDH1A1 (0.45) | ALDH1A1MAPTCASP3TSHRKDM4E | |
| SCHEMBL23534253 | 0.64 | ALDH1A1 (0.46) | ALDH1A1PLIN1MAPTPLIN5ABHD5 | |
| SCHEMBL30058601 | 0.64 | ALDH1A1 (0.46) | ALDH1A1PLIN1MAPTPLIN5ABHD5 | |
| SCHEMBL1351226 | 0.63 | GSK3B (0.35) | ALDH1A1PLIN1MAPTPLIN5ABHD5 | |
| SCHEMBL12133461 | 0.63 | GSK3B (0.35) | ALDH1A1PLIN1MAPTPLIN5ABHD5 | |
| SCHEMBL13579054 | 0.63 | ALDH1A1 (0.33) | ALDH1A1PLIN1MAPTPLIN5ABHD5 |
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-2017106340-A1 | ISOTOPIC FLUORINATION AND APPLICATIONS THEREOF | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2017-06-22 | — | — | WO | disclosed |