Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.49 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.49 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1516558 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL13509243 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL1264788 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL78664 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL30573070 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL16281811 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL439370 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL539846 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL5909518 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL27651920 | 0.84 | ESR1 (0.68) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 |
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-0436936-A2 | Lipid selective anti-oxidants, their production and use | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-07-17 | — | — | EP | disclosed |