Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 7/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 5/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | GSK3A | P49840 | 2/20 | 0.31 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.30 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
| ▸ | PDE6D | O43924 | 1/20 | 0.30 |
| ▸ | PDE6A | P16499 | 1/20 | 0.30 |
| ▸ | PDE6G | P18545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22101541 | 0.84 | MAPT (0.35) | PIK3CBSMN1; SMN2ALDH1A1KDM4ERAB9A | |
| SCHEMBL22101539 | 0.84 | FFAR4 (0.35) | CYP2C9PIK3CBSMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL22101910 | 0.84 | ALDH1A1 (0.34) | CYP2C9SMN1; SMN2ALDH1A1HPGDPIK3CA | |
| SCHEMBL22393586 | 0.81 | CYP2C9 (0.33) | CYP2C9ALDH1A1HPGD | |
| SCHEMBL22101536 | 0.81 | THRB (0.38) | PIK3CBSMN1; SMN2ALDH1A1PIK3CAKDM4E | |
| SCHEMBL22101725 | 0.76 | GRIN1 (0.40) | SMN1; SMN2ALDH1A1HPGDKDM4ERAB9A | |
| SCHEMBL22101522 | 0.76 | PIK3CB (0.37) | PIK3CBPIK3CDPIK3CA | |
| SCHEMBL22101490 | 0.73 | MAPT (0.35) | PIK3CBALDH1A1HPGDKDM4ERAB9A | |
| SCHEMBL22101184 | 0.73 | CRHR1 (0.31) | SMN1; SMN2ALDH1A1LMNAGRIN1GRIN2A | |
| SCHEMBL32688229 | 0.72 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1HPGDKDM4ERAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3666772-A1 | DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2020-06-17 | — | — | EP | disclosed |