Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4055340 | 0.87 | CYP19A1 (0.43) | CYP19A1CYP11B1CYP11B2MEN1PTGES | |
| SCHEMBL4033691 | 0.80 | CYP19A1 (0.43) | CYP19A1CYP11B1CYP11B2MEN1PTGES | |
| SCHEMBL4052061 | 0.78 | CYP19A1 (0.35) | CYP19A1CYP11B1CYP11B2MEN1PTGES | |
| SCHEMBL4061843 | 0.77 | CYP19A1 (0.41) | CYP19A1CYP11B1CYP11B2MEN1PTGES | |
| SCHEMBL4054967 | 0.71 | PDE4A (0.37) | CYP19A1MEN1PTGESALDH1A1CYP1A2 | |
| SCHEMBL2493654 | 0.69 | CYP1A2 (0.36) | MEN1ALDH1A1CYP1A2MAPTCYP2C19 | |
| SCHEMBL6052690 | 0.68 | ALDH1A1 (0.53) | CYP19A1MEN1PTGESALDH1A1CYP1A2 | |
| SCHEMBL8973852 | 0.66 | CYP19A1 (0.56) | CYP19A1MEN1PTGESALDH1A1CYP1A2 | |
| SCHEMBL3303198 | 0.66 | CYP19A1 (0.60) | CYP19A1MEN1PTGESALDH1A1CYP1A2 | |
| SCHEMBL3298617 | 0.65 | CYP19A1 (0.61) | CYP19A1MEN1PTGESALDH1A1CYP1A2 |
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-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |