Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 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 | |
|---|---|---|---|---|
| SCHEMBL20417808 | 0.89 | ACACB (0.41) | SMN1; SMN2ALDH1A1ALOX15HTTATM | |
| SCHEMBL7764049 | 0.87 | TLR8 (0.45) | SMN1; SMN2ALDH1A1ALOX15HTTATM | |
| SCHEMBL20417807 | 0.84 | PIK3CD (0.47) | SMN1; SMN2ALDH1A1ALOX15HTTATM | |
| SCHEMBL3377603 | 0.81 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1ALOX15HTTATM | |
| SCHEMBL15653625 | 0.80 | ACACB (0.42) | SMN1; SMN2ALDH1A1ALOX15HTTATM | |
| SCHEMBL7954619 | 0.79 | SMN1; SMN2 (0.39) | SMN1; SMN2ALDH1A1ALOX15HTTATM | |
| SCHEMBL17563249 | 0.78 | TYR (0.41) | ALDH1A1PDE5AACACBGRM2TYR | |
| SCHEMBL2688931 | 0.78 | ACACB (0.40) | ALDH1A1HTTPDE5AACACBGRM2 | |
| SCHEMBL18186968 | 0.77 | ACACB (0.39) | PDE5AACACBGRM2TYRGAA | |
| SCHEMBL256009 | 0.77 | MAP2K2 (0.41) | PDE5AACACBGRM2TYR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2507243-B1 | SPIROINDOLINONE PYRROLIDINES | HOFFMANN LA ROCHE (CH) | 2015-06-10 | — | — | EP | claimed |
| WO-2018136634-A1 | FUSED HETEROCYCLIC COMPOUNDS AS SELECTIVE BMP INHIBITORS | VANDERBILT UNIVERSITY (US) | 2018-07-26 | — | — | WO | disclosed |
| EP-2507243-B1 | SPIROINDOLINONE PYRROLIDINES | HOFFMANN LA ROCHE (CH) | 2015-06-10 | — | — | EP | disclosed |