Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | RAF1 | P04049 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SPR | P35270 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL780217 | 0.79 | SLC18A3 (0.43) | CYP2C19CYP2D6MAPT | |
| SCHEMBL4075039 | 0.79 | TP53 (0.40) | CYP2C19CYP1A2S1PR1CYP11B2CYP19A1 | |
| SCHEMBL1515154 | 0.78 | CYP11B2 (0.48) | CYP2C19CYP1A2S1PR1CYP11B2CYP19A1 | |
| SCHEMBL6419399 | 0.78 | CYP11B2 (0.54) | CYP2C19CYP1A2S1PR1CYP11B2CYP19A1 | |
| SCHEMBL28048384 | 0.78 | CYP11B2 (0.66) | CYP2C19CYP1A2CYP11B2CYP2D6CYP2C9 | |
| SCHEMBL21724747 | 0.78 | CYP11B2 (0.37) | CYP11B2 | |
| SCHEMBL24556967 | 0.76 | CYP11B2 (0.57) | CYP2C19CYP1A2S1PR1CYP11B2TP53 | |
| SCHEMBL24556963 | 0.76 | CYP11B2 (0.57) | CYP2C19CYP1A2S1PR1CYP11B2TP53 | |
| SCHEMBL29173244 | 0.76 | CYP11B2 (0.57) | CYP2C19CYP1A2S1PR1CYP11B2TP53 | |
| SCHEMBL24602720 | 0.76 | CYP11B2 (0.57) | CYP2C19CYP1A2S1PR1CYP11B2TP53 |
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-105339355-A | Novel CYP17 inhibitor/antiandrogen | ORION CORP | 2016-02-17 | — | — | CN | claimed |
| CN-105339355-A | Novel CYP17 inhibitor/antiandrogen | ORION CORP | 2016-02-17 | — | — | CN | disclosed |