Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WDR5 | P61964 | 3/20 | 0.49 |
| ▸ | TIPARP | Q7Z3E1 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19230513 | 0.89 | KDM4E (0.48) | TIPARPALDH1A1KDM4ECHRM1CA1 | |
| SCHEMBL19230596 | 0.86 | PDK1 (0.49) | WDR5ALDH1A1KDM4ETSHRNPC1 | |
| SCHEMBL19230502 | 0.81 | AKR1C3 (0.52) | ALDH1A1KDM4ECHRM1SMN1; SMN2CA1 | |
| SCHEMBL19230583 | 0.79 | PDK1 (0.49) | WDR5ALDH1A1KDM4ENPC1SMN1; SMN2 | |
| SCHEMBL1263320 | 0.75 | ACACB (0.56) | TSHRCA1CA2KMT2A | |
| SCHEMBL5519074 | 0.75 | DRD1 (0.54) | TIPARPALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL12922780 | 0.74 | NAMPT (0.49) | ALDH1A1KDM4ENPC1SMN1; SMN2RAB9A | |
| SCHEMBL14158144 | 0.74 | ESR1 (0.54) | ALDH1A1NPC1RAB9ACA1CA2 | |
| SCHEMBL29715895 | 0.72 | NAMPT (0.50) | ALDH1A1KDM4ESMN1; SMN2CA1CA2 | |
| SCHEMBL3308449 | 0.72 | NAMPT (0.50) | ALDH1A1KDM4ESMN1; SMN2CA1CA2 |
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 |