Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.45 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | NPY1R | P25929 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CTSB | P07858 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL538895 | 0.83 | POLB (0.77) | POLBNCOA1NCOA3CYP1A2TSHR | |
| SCHEMBL30531716 | 0.81 | POLB (0.74) | POLBNCOA1NCOA3CYP1A2TSHR | |
| Quinoline SCHEMBL28245218 | 0.75 | POLB (0.73) | POLBNCOA1NCOA3CYP1A2TSHR | |
| Hydrochloric Acid SCHEMBL7950313 | 0.74 | POLB (0.96) | POLBNCOA1NCOA3CYP1A2TSHR | |
| SCHEMBL29611471 | 0.72 | POLB (1.00) | POLBNCOA1NCOA3CYP1A2TSHR | |
| SCHEMBL29750649 | 0.72 | POLB (1.00) | POLBNCOA1NCOA3CYP1A2TSHR | |
| SCHEMBL827685 | 0.72 | POLB (1.00) | POLBNCOA1NCOA3CYP1A2TSHR | |
| Quinoline SCHEMBL9110913 | 0.69 | POLB (0.84) | POLBNCOA1NCOA3CYP1A2TSHR | |
| SCHEMBL15761043 | 0.67 | — | — | |
| SCHEMBL13864441 | 0.67 | ALDH1A1 (0.47) | POLBTSHRACHEALDH1A1TDP1 |
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-5648496-A | AMINATION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-07-15 | — | — | US | disclosed |