Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.44 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PRKAB2 | O43741 | 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 | |
|---|---|---|---|---|
| SCHEMBL31196826 | 1.00 | ESR1 (0.51) | ESR1ESR2ALDH1A1CA12CA1 | |
| SCHEMBL8243911 | 0.85 | ESR1 (0.50) | ESR1ESR2ALDH1A1CA12CA1 | |
| SCHEMBL734285 | 0.83 | PTPN11 (0.50) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL10623840 | 0.82 | GAA (0.47) | ESR1ESR2ALDH1A1HSD17B10KMT2A | |
| SCHEMBL10937668 | 0.82 | ALDH1A1 (0.69) | ESR1ESR2ALDH1A1CA12CA1 | |
| SCHEMBL25491034 | 0.81 | ALDH1A1 (0.60) | ESR2ALDH1A1HSD17B10KMT2APTK2B | |
| SCHEMBL13951660 | 0.81 | TSHR (0.50) | ALDH1A1CA1CA2TSHRKMT2A | |
| SCHEMBL13951455 | 0.81 | TSHR (0.51) | ALDH1A1TSHRKMT2APTK2BMCL1 | |
| SCHEMBL31325081 | 0.81 | TSHR (0.51) | ALDH1A1TSHRKMT2APTK2BMCL1 | |
| SCHEMBL4369286 | 0.81 | PTPN11 (0.56) | TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030162866-A1 | Compositions based on phenolic derivatives and their use as mineral binder additives | RHODIA CHIMIE (FR) | 2003-08-28 | — | — | US | claimed |
| US-20030162866-A1 | Compositions based on phenolic derivatives and their use as mineral binder additives | RHODIA CHIMIE (FR) | 2003-08-28 | — | — | US | disclosed |