Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 4/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6912632 | 0.86 | LMNA (0.45) | KDM4EGAAMAPTACHESIGMAR1 | |
| SCHEMBL6910244 | 0.83 | PYCR1 (0.41) | KDM4EGAAMAPTACHESIGMAR1 | |
| SCHEMBL6911131 | 0.81 | SIGMAR1 (0.37) | KDM4EGAAMAPTACHESIGMAR1 | |
| Hydrochloric Acid SCHEMBL6912379 | 0.80 | SIGMAR1 (0.37) | KDM4EGAAMAPTACHESIGMAR1 | |
| SCHEMBL6910453 | 0.73 | SIGMAR1 (0.52) | KDM4EACHESIGMAR1NR1I2LMNA | |
| SCHEMBL27293018 | 0.72 | IDH1 (0.38) | ESR1ESR2CYP3A4TACR1CNR1 | |
| SCHEMBL6905693 | 0.71 | CYP2D6 (0.44) | KDM4EACHESIGMAR1NR1I2LMNA | |
| SCHEMBL6910481 | 0.70 | MEN1 (0.44) | KDM4EGAAMAPTACHESIGMAR1 | |
| SCHEMBL6907465 | 0.70 | TMEM97 (0.46) | ACHESIGMAR1ALDH1A1TMEM97BCHE | |
| SCHEMBL10783577 | 0.70 | ESR1 (0.53) | KDM4ESLC6A2SLC6A4ALDH1A1ESR1 |
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-1112998-B1 | AMINE DERIVATIVES | POLA CHEM IND INC (JP) | 2004-12-08 | — | — | EP | disclosed |
| US-6586633-B1 | Antifungal agents | POLA CHEMICAL INDUSTRIES, INC. (JP) | 2003-07-01 | — | — | US | disclosed |
| EP-1112998-A1 | AMINE DERIVATIVES | POLA CHEMICAL INDUSTRIES, INC. (JP) | 2001-07-04 | — | — | EP | disclosed |