Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD5 | P21918 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.37 |
| ▸ | TAS1R2 | Q8TE23 | 3/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19230525 | 0.88 | TAS1R3 (0.46) | DRD2DRD1DRD4DRD5TAS1R3 | |
| SCHEMBL19230591 | 0.83 | DRD2 (0.43) | DRD2DRD1DRD4DRD5LMNA | |
| SCHEMBL19230805 | 0.78 | ESR1 (0.49) | POLBSMN1; SMN2CA12CA1CA2 | |
| SCHEMBL19230672 | 0.78 | ESR2 (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL19230656 | 0.78 | ESR1 (0.49) | POLBSMN1; SMN2CA12CA1CA2 | |
| SCHEMBL19230310 | 0.78 | ESR1 (0.49) | POLBSMN1; SMN2CA12CA1CA2 | |
| SCHEMBL19230674 | 0.75 | NR1H4 (0.57) | — | |
| SCHEMBL19230677 | 0.75 | FAAH (0.35) | TAS1R3TAS1R1TAS1R2TDP1L3MBTL1 | |
| SCHEMBL19230813 | 0.75 | FAAH (0.35) | TAS1R3TAS1R1TAS1R2TDP1L3MBTL1 | |
| SCHEMBL19284499 | 0.72 | MAPT (0.37) | SMN1; SMN2CA12CA1CA2CA7 |
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 |