Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 10/20 | 0.33 |
| ▸ | TYMP | P19971 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL10336354 | 0.98 | TSHR (0.36) | CYP19A1GCGRTYMPTSHRTHRB | |
| SCHEMBL9503325 | 0.98 | TSHR (0.36) | CYP19A1GCGRTYMPTSHRTHRB | |
| SCHEMBL9503320 | 0.98 | TSHR (0.36) | CYP19A1GCGRTYMPTSHRTHRB | |
| SCHEMBL9503366 | 0.98 | TSHR (0.36) | CYP19A1GCGRTYMPTSHRTHRB | |
| SCHEMBL9503180 | 0.93 | NPC1 (0.35) | GCGRTYMP | |
| SCHEMBL10446746 | 0.93 | CYP19A1 (0.38) | CYP19A1GCGRTYMPTSHRTHRB | |
| Hexane SCHEMBL27851252 | 0.93 | CYP19A1 (0.38) | CYP19A1GCGRTYMPTSHRTHRB | |
| SCHEMBL28164639 | 0.90 | TSHR (0.42) | CYP19A1TYMPTSHRTHRBCYP3A4 | |
| SCHEMBL1687611 | 0.90 | TSHR (0.42) | CYP19A1TYMPTSHRTHRBCYP3A4 | |
| SCHEMBL9505791 | 0.87 | ESR1 (0.40) | CYP19A1GCGRTSHRCYP3A4PTGS2 |
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-0364548-B1 | OCTAFLUOROBIPHENYLS | MERCK PATENT GmbH (DE) | 1993-06-09 | — | — | EP | disclosed |