Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.31 |
| ▸ | RARB | P10826 | 1/20 | 0.31 |
| ▸ | RARG | P13631 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ALPL | P05186 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6602632 | 0.77 | PTGS1 (0.43) | ALDH1A1SIGMAR1PTGS1PTGS2PDE3B | |
| SCHEMBL6533645 | 0.76 | HTR2A (0.39) | ALDH1A1ESR1DRD2 | |
| SCHEMBL4620312 | 0.75 | ESR1 (0.38) | ALDH1A1PTGS1PTGS2ESR1 | |
| SCHEMBL3069374 | 0.74 | LPL (0.39) | ALDH1A1 | |
| SCHEMBL3074106 | 0.74 | BCL2L1 (0.49) | ALDH1A1RARARARBRARGESR1 | |
| SCHEMBL3068540 | 0.73 | ESR1 (0.49) | ALDH1A1PTGS1PTGS2ESR1 | |
| SCHEMBL3082420 | 0.73 | LPL (0.38) | ALDH1A1PTGS1PTGS2ESR1 | |
| SCHEMBL3133913 | 0.71 | ESR1 (0.34) | ALDH1A1ESR1 | |
| SCHEMBL3072806 | 0.69 | BRD4 (0.48) | PTGS1PTGS2 | |
| SCHEMBL3135618 | 0.69 | ESR1 (0.54) | ALDH1A1ESR1 |
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-1891026-B1 | CYCLOALKYLIDENE COMPOUNDS AS SELECTIVE ESTROGEN RECEPTOR MODULATORS | GLAXOSMITHKLINE LLC (US) | 2010-07-14 | — | — | EP | claimed |