Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | MAOA | P21397 | 2/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.52 |
| ▸ | DRD5 | P21918 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 5/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL22081972 | 0.96 | CYP1A2 (0.62) | CYP1A2MAOAMAOBDRD2DRD1 | |
| SCHEMBL1525601 | 0.96 | — | — | |
| SCHEMBL109650 | 0.96 | CYP1A2 (0.62) | CYP1A2MAOAMAOBDRD2DRD1 | |
| SCHEMBL29881712 | 0.96 | — | — | |
| Ammonia Solution, Strong SCHEMBL656057 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL4314909 | 0.92 | — | — | |
| Benzene SCHEMBL19894402 | 0.92 | CYP1A2 (0.59) | CYP1A2MAOAMAOBDRD2DRD1 | |
| SCHEMBL7913483 | 0.92 | CYP1A2 (0.59) | CYP1A2MAOAMAOBDRD2DRD1 | |
| Bromide SCHEMBL2085597 | 0.92 | — | — | |
| Water SCHEMBL2528680 | 0.92 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1086522-A | The preparation method of epoxy-terminated polymers | EASTMAN KODAK CO (US) | 1994-05-11 | — | — | CN | disclosed |