Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 14/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 14/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.50 |
| ▸ | CDC42 | P60953 | 1/20 | 0.50 |
| ▸ | RAC1 | P63000 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.50 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.40 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.40 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.40 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.40 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.40 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8501435 | 0.88 | APP (0.56) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL8497582 | 0.88 | AKR1C3 (0.59) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL8497441 | 0.85 | AKR1C3 (0.55) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL8501466 | 0.85 | AKR1C3 (0.55) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL8502209 | 0.85 | AKR1C3 (0.59) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL8501245 | 0.84 | AKR1C3 (0.54) | APPCYP2C19AKR1C3AKR1C2PTGS2 | |
| SCHEMBL8498571 | 0.83 | AKR1C3 (0.40) | AKR1C3AKR1C2FFAR1 | |
| SCHEMBL7200140 | 0.83 | ESR1 (0.49) | — | |
| SCHEMBL7200144 | 0.83 | ESR1 (0.49) | — | |
| SCHEMBL8497703 | 0.82 | AKR1C3 (0.52) | APPCYP2C19AKR1C3AKR1C2PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5916916-A | USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. | ELI LILLY AND COMPANY (US) | 1999-06-29 | — | — | US | claimed |
| US-5916916-A | USEFUL AS SELECTIVE ESTROGEN RECEPTOR MODULATORS. | ELI LILLY AND COMPANY (US) | 1999-06-29 | — | — | US | disclosed |