Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29600683 | 0.82 | TRPA1 (0.39) | EGFRCYP2C9BACE1MEN1KMT2A | |
| SCHEMBL668126 | 0.82 | TRPA1 (0.39) | EGFRCYP2C9BACE1MEN1KMT2A | |
| SCHEMBL20428093 | 0.81 | AXL (0.33) | CYP2C9BACE1MEN1KMT2AALDH1A1 | |
| SCHEMBL20194342 | 0.77 | CSNK2A1 (0.41) | BACE1MEN1KMT2AALDH1A1 | |
| SCHEMBL7932114 | 0.77 | BACE1 (0.33) | BACE1 | |
| SCHEMBL20194348 | 0.76 | HSD17B1 (0.33) | BACE1MEN1KMT2AALDH1A1HTT | |
| SCHEMBL4073582 | 0.75 | THRB (0.46) | CYP2C9MEN1KMT2AALDH1A1HTT | |
| SCHEMBL23585808 | 0.74 | LMNA (0.47) | CYP2C9MEN1KMT2AALDH1A1HTT | |
| SCHEMBL29388672 | 0.73 | LMNA (0.43) | CYP2C9 | |
| SCHEMBL27497963 | 0.73 | IP6K1 (0.40) | BACE1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3061758-B1 | 5-SUBSTITUTED ISOINDOLINE COMPOUNDS | CELGENE CORP (US) | 2018-01-31 | — | — | EP | disclosed |