Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.46 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.46 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | P2RX1 | P51575 | 3/20 | 0.39 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1996062 | 0.84 | ALDH1A1 (0.55) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| SCHEMBL816365 | 0.84 | CYP19A1 (0.48) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| SCHEMBL9312899 | 0.84 | CYP19A1 (0.54) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| SCHEMBL1005841 | 0.84 | TSHR (0.55) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| Hydrochloric Acid SCHEMBL28212666 | 0.82 | TSHR (0.53) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| Hydrazine SCHEMBL28307217 | 0.80 | TSHR (0.52) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| SCHEMBL29658338 | 0.77 | TSHR (0.48) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| SCHEMBL15545359 | 0.77 | CYP19A1 (0.41) | ALDH1A1TSHRCYP3A4TDP1HIF1A | |
| SCHEMBL1505899 | 0.77 | TSHR (0.48) | ALDH1A1TSHRCYP3A4TDP1HPGD | |
| SCHEMBL2976324 | 0.76 | ALDH1A1 (0.47) | ALDH1A1TSHRCYP3A4TDP1HPGD |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6806388-B2 | Polyfluorinated aromatic or heterocyclic derivatives with sulphurpentalfluoride group(s) | F2 CHEMICALS LIMITED (GB) | 2004-10-19 | — | — | US | claimed |
| EP-1341756-A1 | POLYFLUORINATED AROMATIC OR HETEROCYCLIC DERIVATIVES WITH SULPHURPENTAFLUORIDE GROUP(S) | F2 Chemicals Limited (GB) | 2003-09-10 | — | — | EP | claimed |
| US-20030096999-A1 | Polyfluorinated aromatic or heterocyclic derivatives with sulphurpentalfuoride group(s) | F2 CHEMICALS LIMITED (GB) | 2003-05-22 | — | — | US | claimed |
| WO-2002042263-A1 | POLYFLUORINATED AROMATIC OR HETEROCYCLIC DERIVATIVES WITH SULPHURPENTAFLUORIDE GROUP(S) | F2 CHEMICALS LIMITED (GB) | 2002-05-30 | — | — | WO | claimed |
| EP-1341756-A1 | POLYFLUORINATED AROMATIC OR HETEROCYCLIC DERIVATIVES WITH SULPHURPENTAFLUORIDE GROUP(S) | F2 Chemicals Limited (GB) | 2003-09-10 | — | — | EP | disclosed |
| US-20030096999-A1 | Polyfluorinated aromatic or heterocyclic derivatives with sulphurpentalfuoride group(s) | F2 CHEMICALS LIMITED (GB) | 2003-05-22 | — | — | US | disclosed |
| WO-2002042263-A1 | POLYFLUORINATED AROMATIC OR HETEROCYCLIC DERIVATIVES WITH SULPHURPENTAFLUORIDE GROUP(S) | F2 CHEMICALS LIMITED (GB) | 2002-05-30 | — | — | WO | disclosed |