Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 4/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 2/20 | 0.34 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.34 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.34 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | GAK | O14976 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | BCL9 | O00512 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4050927 | 0.85 | CYP17A1 (0.39) | CYP17A1CYP19A1CYP11B1CYP11B2HSD17B10 | |
| SCHEMBL13693817 | 0.85 | PON1 (0.40) | CYP17A1CYP19A1CYP11B1CYP11B2HSD17B10 | |
| SCHEMBL4011420 | 0.79 | CYP17A1 (0.47) | CYP17A1CYP19A1CYP11B1CYP11B2HSD17B10 | |
| SCHEMBL13693816 | 0.75 | GAK (0.38) | HSD17B10ALDH1A1HPGDPIM1CSNK2A2 | |
| SCHEMBL5022806 | 0.74 | TBK1 (0.47) | HSD17B10ALDH1A1HPGDPIM1PIM2 | |
| SCHEMBL4062570 | 0.74 | ESRRA (0.37) | ESRRAIDH1PDE5AMAPT | |
| SCHEMBL4239976 | 0.72 | PDE4A (0.39) | ESRRAHSD17B10ALDH1A1HPGDPIM1 | |
| SCHEMBL4051687 | 0.71 | MAOA (0.51) | HSD17B10ALDH1A1HPGDRAB9AGAA | |
| SCHEMBL9989279 | 0.67 | SCN9A (0.46) | HSD17B10CASP1RAB9AGAAMAPT | |
| SCHEMBL25786471 | 0.67 | DAO (0.43) | MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |
| WO-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |