Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 3/20 | 0.42 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2387567 | 1.00 | ESR1 (0.46) | ESR1CA12CA1CA2CA3 | |
| SCHEMBL10019278 | 0.84 | ALDH1A1 (0.47) | ESR1CES2CES1PTGS2ALDH1A1 | |
| SCHEMBL20254287 | 0.81 | ESR1 (0.48) | ESR1CA12CA1CA2CA3 | |
| SCHEMBL12262995 | 0.81 | CA12 (0.48) | ESR1CA12CA1CA2CA3 | |
| SCHEMBL2883723 | 0.80 | CA2 (0.58) | CA12CA1CA2CA3CA4 | |
| SCHEMBL11844374 | 0.80 | ESR1 (0.56) | ESR1CA12CA1CA2CA3 | |
| SCHEMBL6429964 | 0.80 | CA2 (0.58) | CA12CA1CA2CA3CA4 | |
| SCHEMBL2883726 | 0.80 | CA2 (0.58) | CA12CA1CA2CA3CA4 | |
| SCHEMBL1035354 | 0.80 | ESR1 (0.56) | ESR1CA12CA1CA2CA3 | |
| SCHEMBL3902058 | 0.80 | ESR1 (0.56) | ESR1CA12CA1CA2CA3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8021540-B2 | Method of desulfurizing hydrocarbon oil | JAPAN ENERGY CORPORATION (JP) | 2011-09-20 | — | — | US | disclosed |
| US-20090000990-A1 | Method of Desulfurizing Hydrocarbon Oil | JAPAN ENERGY CORPORATION (JP) | 2009-01-01 | — | — | US | disclosed |
| EP-1715025-A1 | METHOD OF DESULFURIZING HYDROCARBON OIL | JAPAN ENERGY CORPORATION (JP) | 2006-10-25 | — | — | EP | disclosed |