Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7725794 | 0.83 | L3MBTL1 (0.38) | CYP2C19TP53RAB9AMEN1CYP1A2 | |
| SCHEMBL7730042 | 0.82 | MMP2 (0.38) | CYP2C19RAB9AMEN1CYP1A2CYP2C9 | |
| SCHEMBL7725820 | 0.79 | TSPO (0.37) | ALDH1A1ACHE | |
| SCHEMBL7724597 | 0.79 | ALDH1A1 (0.35) | LMNAALDH1A1MEN1KMT2AACHE | |
| SCHEMBL7725831 | 0.79 | FAAH (0.38) | ALOX5ALDH1A1TP53RAB9ACYP26A1 | |
| SCHEMBL7730011 | 0.77 | ATM (0.50) | LMNAALDH1A1MEN1KMT2AKEAP1 | |
| SCHEMBL7723373 | 0.77 | ALDH1A1 (0.47) | LMNAALDH1A1RAB9AMEN1KMT2A | |
| SCHEMBL7724611 | 0.76 | MMP13 (0.40) | TP53RAB9APKM | |
| SCHEMBL7724618 | 0.76 | MAPT (0.38) | ALDH1A1TP53MEN1KMT2A | |
| SCHEMBL7720010 | 0.76 | PKM (0.42) | LMNAALDH1A1MEN1KMT2AKEAP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6403818-B1 | ONE POT PROCESS STARTING FROM CARBONYL COMPOUND, ALCOHOL, THIOL OR AMINE, AND PROTECTED HYDROXYDICYANO COMPOUND | EISAI CO., LTD. (JP) | 2002-06-11 | — | — | US | disclosed |