Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29458062 | 0.86 | — | — | |
| SCHEMBL593274 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL183345 | 0.84 | ALOX15 (0.59) | ALOX15CYP3A4HSD17B10TSHRKDM4E | |
| Hydrochloric Acid SCHEMBL30403038 | 0.84 | ALOX15 (0.59) | ALOX15CYP3A4HSD17B10TSHRKDM4E | |
| Water SCHEMBL6757210 | 0.84 | ALOX15 (0.59) | ALOX15CYP3A4HSD17B10TSHRKDM4E | |
| Hydrochloric Acid SCHEMBL1119370 | 0.81 | ALOX15 (0.56) | ALOX15CYP3A4HSD17B10TSHRKDM4E | |
| SCHEMBL69654 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL766671 | 0.75 | G6PD (0.54) | ALOX15CYP3A4HSD17B10TSHRKDM4E | |
| Questiomycin B SCHEMBL7457859 | 0.74 | ALOX15 (0.65) | ALOX15CYP3A4HSD17B10TSHRKDM4E | |
| Questiomycin B SCHEMBL7603625 | 0.73 | ALOX15 (0.71) | ALOX15CYP3A4HSD17B10TSHRKDM4E |
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-0312931-B1 | PROCESS FOR THE PREPARATION OF AMINO-1,3 BENZENEDIOL | THE DOW CHEMICAL COMPANY (US) | 1993-04-21 | — | — | EP | claimed |