Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | LCK | P06239 | 2/20 | 0.36 |
| ▸ | RARB | P10826 | 2/20 | 0.36 |
| ▸ | RARA | P10276 | 1/20 | 0.36 |
| ▸ | RARG | P13631 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | ESRRG | P62508 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27740953 | 0.88 | EGFR (0.37) | EGFRLCKRARBALDH1A1CA12 | |
| SCHEMBL27857292 | 0.85 | NPC1 (0.39) | CXCR3EGFRLCKALDH1A1CA12 | |
| SCHEMBL27761928 | 0.82 | PPARA (0.41) | CXCR3RARBRARARARGPPARA | |
| SCHEMBL28780217 | 0.81 | HSD17B1 (0.42) | EGFRLCKALDH1A1CA12CA1 | |
| SCHEMBL497820 | 0.76 | RXRA (0.41) | EGFRLCKRARBALDH1A1CA12 | |
| SCHEMBL27762017 | 0.74 | PLK1 (0.40) | EGFRLCKALDH1A1ESRRGPPARA | |
| SCHEMBL28126806 | 0.73 | CA12 (0.57) | EGFRLCKALDH1A1CA12CA1 | |
| SCHEMBL39010 | 0.73 | CA12 (0.57) | EGFRLCKALDH1A1CA12CA1 | |
| SCHEMBL3873135 | 0.72 | CA12 (0.55) | EGFRLCKALDH1A1CA12CA1 | |
| SCHEMBL27658957 | 0.72 | CA12 (0.55) | EGFRLCKALDH1A1CA12CA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101448791-B | Fxr agonists | LILLY CO ELI | 2011-11-16 | — | — | CN | disclosed |
| CN-101448798-A | Compounds and methods for modulating FXR | LILLY CO ELI (US) | 2009-06-03 | — | — | CN | disclosed |
| CN-101448791-A | FXR agonists | LILLY CO ELI (US) | 2009-06-03 | — | — | CN | disclosed |