Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | EDNRA | P25101 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | XDH | P47989 | 2/20 | 0.42 |
| ▸ | LCK | P06239 | 2/20 | 0.42 |
| ▸ | RXRA | P19793 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8154670 | 1.00 | CYP1A2 (0.53) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL8142380 | 0.86 | CYP1A2 (0.73) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL8142377 | 0.86 | CYP1A2 (0.73) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL2222358 | 0.86 | CYP1A2 (0.73) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL8142274 | 0.85 | CYP1A2 (0.60) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL8142277 | 0.85 | CYP1A2 (0.60) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL8142275 | 0.85 | CYP1A2 (0.60) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL7927229 | 0.84 | CYP1A2 (0.74) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL5712302 | 0.84 | CYP1A2 (0.74) | CYP1A2GLACYP3A4MAPTTSHR | |
| SCHEMBL5712301 | 0.84 | CYP1A2 (0.74) | CYP1A2GLACYP3A4MAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6028116-A | Substituted condensation products of 1H-indenyl-hydroxyalkanes with aldehydes for neoplasia | CELL PATHWAYS, INC. (US) | 2000-02-22 | — | — | US | disclosed |