Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | STS | P08842 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12437198 | 0.84 | MAPT (0.52) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL275853 | 0.84 | KMT2A (0.48) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL276700 | 0.84 | ERN1 (0.47) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL276104 | 0.84 | PTGDR2 (0.48) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL12437199 | 0.83 | CYP3A4 (0.45) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL931499 | 0.83 | ERN1 (0.46) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL24515546 | 0.81 | ERN1 (0.54) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL20240279 | 0.80 | LMNA (0.67) | ERN1ALDH1A1CA1CA2KMT2A | |
| SCHEMBL12225947 | 0.78 | ERN1 (0.56) | ERN1ALDH1A1KMT2ALMNAMAPT | |
| SCHEMBL12260930 | 0.77 | CA1 (0.62) | ALDH1A1CA1CA2KMT2ALMNA |
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-2235017-B1 | SPIROINDOLINONE DERIVATIVES AS ANTICANCER AGENTS | HOFFMANN LA ROCHE (CH) | 2011-09-14 | — | — | EP | disclosed |
| EP-2229396-B1 | SPIROINDOLINONE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2011-08-10 | — | — | EP | disclosed |