Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 4/20 | 0.72 |
| ▸ | ESR1 | P03372 | 3/20 | 0.72 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.44 |
| ▸ | TUBB | P07437 | 1/20 | 0.44 |
| ▸ | YES1 | P07947 | 1/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.44 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.44 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.44 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.44 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.44 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19230616 | 0.85 | ESR2 (0.65) | ESR2ESR1TDP1ALDH1A1CYP19A1 | |
| SCHEMBL15913830 | 0.84 | ESR2 (1.00) | ESR2ESR1TDP1ARALDH1A1 | |
| SCHEMBL28649906 | 0.81 | ESR1 (0.53) | ESR2ESR1TDP1ARCYP3A4 | |
| SCHEMBL4361595 | 0.79 | ESR2 (0.82) | ESR2ESR1ARCYP19A1TUBB4A | |
| SCHEMBL17761485 | 0.77 | ABCB1 (0.48) | ESR2ESR1TDP1ARCYP19A1 | |
| SCHEMBL4364022 | 0.76 | ESR2 (0.83) | ESR2ESR1ARCYP19A1TUBB4A | |
| SCHEMBL27517082 | 0.76 | ESR2 (0.83) | ESR2ESR1TDP1ARCYP19A1 | |
| SCHEMBL18144926 | 0.76 | TDP1 (0.55) | TDP1ALDH1A1MAPK1POLBAPEX1 | |
| SCHEMBL30036421 | 0.76 | TDP1 (0.59) | ESR2ESR1TDP1ALDH1A1MEN1 | |
| SCHEMBL8372906 | 0.76 | TDP1 (0.72) | ESR2ESR1TDP1ALDH1A1AKR1B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108602811-B | FXR receptor agonists | 轩竹生物科技有限公司 | 2021-11-16 | — | — | CN | disclosed |
| WO-2017133521-A1 | FXR RECEPTOR AGONIST | 山东轩竹医药科技有限公司 | 2017-08-10 | — | — | WO | disclosed |