Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 7/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 2/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.32 |
| ▸ | BCR | P11274 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8768624 | 0.85 | MEN1 (0.36) | CYP1A2ESR1ESR2HIF1AMEN1 | |
| SCHEMBL8768568 | 0.81 | ESR2 (0.39) | ESR1ESR2ABL1ABCB1BCR | |
| SCHEMBL7560657 | 0.74 | CYP1A2 (0.39) | CYP1A2ESR1ESR2CYP3A4ALOX15 | |
| SCHEMBL7558830 | 0.73 | CYP17A1 (0.40) | CYP1A2ESR1ESR2CYP3A4ALOX15 | |
| SCHEMBL9144711 | 0.72 | CYP1A2 (0.41) | CYP1A2ESR1ESR2CYP3A4ALOX15 | |
| SCHEMBL7558569 | 0.71 | CYP17A1 (0.36) | CYP1A2ESR1ESR2TDP1MAPT | |
| SCHEMBL7558883 | 0.70 | LTA4H (0.37) | CYP1A2ESR1ESR2TSHRTDP1 | |
| SCHEMBL3271256 | 0.69 | ESR1 (0.42) | CYP1A2ESR1ESR2HIF1AMEN1 | |
| SCHEMBL7558570 | 0.68 | LTA4H (0.35) | CYP1A2ESR1TRPV1CYP3A4TSHR | |
| SCHEMBL30450739 | 0.67 | CYP17A1 (0.58) | CYP1A2ESR1ESR2CYP3A4ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0792255-A1 | LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1997-09-03 | — | — | EP | disclosed |
| EP-0638112-A1 | LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-02-15 | — | — | EP | disclosed |