Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 14/20 | 0.51 |
| ▸ | ESR1 | P03372 | 4/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7453762 | 0.90 | KIF11 (0.59) | KIF11CYP3A4KCNH2CYP2D6CYP2C9 | |
| SCHEMBL9172236 | 0.88 | KIF11 (0.57) | KIF11CYP3A4KCNH2CYP2D6CYP2C9 | |
| SCHEMBL6551716 | 0.88 | KIF11 (0.61) | KIF11CYP3A4KCNH2CYP2D6CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL2922340 | 0.86 | KIF11 (0.59) | KIF11CYP3A4KCNH2CYP2D6CYP2C9 | |
| SCHEMBL28363183 | 0.85 | CHRM4 (0.49) | KIF11ESR1ESR2ALDH1A1CYP3A4 | |
| SCHEMBL3179897 | 0.84 | ESR1 (0.50) | KIF11ESR1ESR2ALDH1A1CYP3A4 | |
| SCHEMBL9164873 | 0.84 | ESR1 (0.55) | KIF11ESR1ESR2ALDH1A1CYP3A4 | |
| SCHEMBL28044272 | 0.84 | ESR1 (0.55) | KIF11ESR1ESR2ALDH1A1CYP3A4 | |
| SCHEMBL3137055 | 0.81 | ESR2 (0.61) | KIF11ESR1ESR2ALDH1A1CYP3A4 | |
| SCHEMBL11709377 | 0.80 | ESR1 (0.55) | KIF11ESR1ESR2ALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102821860-A | Process for assembling elements contacting biological substances | OLIVETTI PERSONAL COMP SPA | 2012-12-12 | — | — | CN | disclosed |
| US-4040994-A | OF A NON-FATTY POLYEPOXIDE COMPOUND, AT LEAST TWO EPOXIDIZED FATTY ACID ESTERS AND A POLYCARBOXYLIC ACID ANHYDRIDE CURING AGENT | UNITECH CHEMICAL INC. (US) | 1977-08-09 | — | — | US | disclosed |