Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.33 |
| ▸ | VNN1 | O95497 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24858305 | 0.88 | CCNB2 (0.31) | — | |
| SCHEMBL24858675 | 0.82 | NPC1 (0.33) | NPC1 | |
| SCHEMBL24858713 | 0.74 | HDAC8 (0.41) | MAPK1SRD5A2HDAC3HDAC1HDAC2 | |
| SCHEMBL24858681 | 0.70 | DGAT2 (0.37) | CNR1CNR2 | |
| SCHEMBL23559727 | 0.66 | KDM4E (0.43) | HPGDHTTTSHRHSD17B10TDP1 | |
| SCHEMBL25015127 | 0.65 | KDM4E (0.41) | NPC1SMN1; SMN2KMT2ACYP2D6HSD17B10 | |
| SCHEMBL10697158 | 0.64 | SRD5A2 (0.80) | MAPK1SRD5A2HPGDCNR1CNR2 | |
| SCHEMBL51827 | 0.64 | SRD5A2 (0.80) | MAPK1SRD5A2HPGDCNR1CNR2 | |
| SCHEMBL9065412 | 0.64 | SRD5A2 (0.80) | MAPK1SRD5A2HPGDCNR1CNR2 | |
| SCHEMBL1681512 | 0.64 | SRD5A2 (0.80) | MAPK1SRD5A2HPGDCNR1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023272410-A1 | ERα RECEPTOR COVALENT BINDING ANTAGONIST | 北京盛诺基医药科技股份有限公司 | 2023-01-05 | — | — | WO | disclosed |