Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.55 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | EDNRA | P25101 | 2/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | EDNRB | P24530 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | USP1 | O94782 | 1/20 | 0.43 |
| ▸ | USP8 | P40818 | 1/20 | 0.43 |
| ▸ | OTUB1 | Q96FW1 | 1/20 | 0.43 |
| ▸ | USP36 | Q9P275 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30863682 | 1.00 | PTGS2 (0.55) | PTGS2NAPRTEDNRACYP11B1CYP2A6 | |
| SCHEMBL28404373 | 0.84 | PTGS2 (0.54) | PTGS2NAPRTEDNRACYP11B1CYP2A6 | |
| SCHEMBL5488230 | 0.84 | CA2 (0.56) | PTGS2EDNRACYP11B1CYP2A6ALDH1A1 | |
| SCHEMBL22534535 | 0.81 | ALDH1A1 (0.47) | PTGS2ALDH1A1NAMPTTP53MAPT | |
| SCHEMBL7414818 | 0.81 | ALDH1A1 (0.47) | PTGS2ALDH1A1NAMPTTP53MAPT | |
| SCHEMBL232659 | 0.81 | CASP1 (0.47) | PTGS2EDNRACYP2A6ALDH1A1EDNRB | |
| SCHEMBL29743050 | 0.81 | CASP1 (0.47) | PTGS2EDNRACYP2A6ALDH1A1EDNRB | |
| Lithium SCHEMBL3173875 | 0.79 | CASP1 (0.46) | PTGS2EDNRACYP2A6ALDH1A1EDNRB | |
| SCHEMBL29194067 | 0.79 | CASP1 (0.46) | PTGS2EDNRACYP2A6ALDH1A1EDNRB | |
| SCHEMBL28934633 | 0.79 | CASP1 (0.46) | PTGS2EDNRACYP2A6ALDH1A1EDNRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0011460-B1 | PEROXYGEN BLEACHING AND COMPOSITIONS THEREFOR | FMC Corporation (US) | 1982-09-29 | — | — | EP | claimed |