Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | TPMT | P51580 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 5/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9142398 | 0.85 | CA12 (0.54) | CA12CA1CA2CA4CA6 | |
| SCHEMBL9578546 | 0.83 | TSHR (0.41) | ALDH1A1HSD17B10HPGDTSHRRAB9A | |
| SCHEMBL9145697 | 0.83 | TSHR (0.41) | ALDH1A1HSD17B10HPGDTSHRRAB9A | |
| SCHEMBL9147212 | 0.79 | TSHR (0.48) | CA1CA2ALDH1A1HSD17B10USP2 | |
| SCHEMBL9141752 | 0.79 | TSHR (0.48) | CA1CA2ALDH1A1HSD17B10USP2 | |
| SCHEMBL9578569 | 0.76 | TSHR (0.41) | ALDH1A1HSD17B10USP2TSHRRAB9A | |
| SCHEMBL9144507 | 0.76 | TSHR (0.41) | ALDH1A1HSD17B10USP2TSHRRAB9A | |
| SCHEMBL28967610 | 0.76 | KDM4E (0.43) | CA12CA1CA2CA4CA6 | |
| SCHEMBL1440735 | 0.75 | CA12 (0.36) | CA12CA1CA2CA4CA6 | |
| SCHEMBL1443416 | 0.74 | ALDH1A1 (0.38) | CA12CA1CA2CA4CA6 |
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-2473474-A2 | FLUOROETHER FUNCTIONALIZED AROMATIC DIESTERS AND DERIVATIVES THEREOF | E. I. du Pont de Nemours and Company (US) | 2012-07-11 | — | — | EP | disclosed |