Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LIG1 | P18858 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | MAP1LC3B | Q9GZQ8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9868725 | 0.89 | LIG1 (0.38) | SRD5A1RAB9ASLC6A3SLC6A2SLC6A4 | |
| SCHEMBL15282087 | 0.67 | SRD5A1 (0.43) | SRD5A1RAB9ASLC6A3SLC6A2SLC6A4 | |
| SCHEMBL512106 | 0.64 | SRD5A1 (0.41) | SRD5A1RAB9ASLC6A3SLC6A2SLC6A4 | |
| SCHEMBL6098240 | 0.63 | TP53 (0.44) | SRD5A1RAB9ASLC6A3SLC6A2SLC6A4 | |
| SCHEMBL15874655 | 0.63 | KDM4E (0.42) | SRD5A1ALDH1A1SMN1; SMN2POLBLIG1 | |
| SCHEMBL22201142 | 0.63 | TP53 (0.51) | SRD5A1SLC6A3SLC6A2SLC6A4ALDH1A1 | |
| SCHEMBL14458006 | 0.63 | TP53 (0.51) | SRD5A1SLC6A3SLC6A2SLC6A4ALDH1A1 | |
| SCHEMBL1616775 | 0.63 | KDM4E (0.42) | SRD5A1ALDH1A1SMN1; SMN2POLBLIG1 | |
| SCHEMBL2872986 | 0.63 | HTR3A (0.42) | SRD5A1RAB9ASLC6A3SLC6A2SLC6A4 | |
| SCHEMBL3536658 | 0.63 | ESR2 (0.64) | SRD5A1RAB9AALDH1A1SMN1; SMN2POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0539372-A1 | THERAPEUTIC AGENTS | The Boots Company PLC (GB) | 1993-05-05 | — | — | EP | disclosed |
| WO-1991011448-A1 | THERAPEUTIC AGENTS | THE BOOTS COMPANY PLC (GB) | 1991-08-08 | — | — | WO | disclosed |