Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 5/20 | 0.46 |
| ▸ | WDR5 | P61964 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2328990 | 0.83 | SLC22A12 (0.46) | SLC22A12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL13948301 | 0.77 | CA1 (0.53) | SLC22A12WDR5ALDH1A1KDM4EMAPT | |
| SCHEMBL2325577 | 0.77 | WDR5 (0.51) | WDR5ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL30400362 | 0.71 | HSP90AA1 (0.49) | SLC22A12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL28203556 | 0.71 | CA1 (0.47) | SLC22A12WDR5ALDH1A1KDM4EMAPT | |
| SCHEMBL29666490 | 0.71 | SIGMAR1 (0.67) | GAASIGMAR1 | |
| SCHEMBL1614544 | 0.71 | SIGMAR1 (0.67) | GAASIGMAR1 | |
| SCHEMBL28474429 | 0.69 | WDR5 (0.44) | WDR5ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL28622351 | 0.69 | SLC22A12 (0.41) | SLC22A12ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL12212890 | 0.68 | ALDH1A1 (0.53) | SLC22A12WDR5ALDH1A1KDM4ECA1 |
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-2357177-A1 | HELICENE DERIVATIVE, AXIALLY ASYMMETRIC AMINO ACID, AMINE OR AMINOALCOHOL DERIVATIVE, PERYLENE DERIVATIVE OR SALT THEREOF, AND METHODS FOR PRODUCING SAME | Kyoto University (JP) | 2011-08-17 | — | — | EP | disclosed |
| WO-2010047318-A1 | HELICENE DERIVATIVE, AXIALLY ASYMMETRIC AMINO ACID, AMINE OR AMINOALCOHOL DERIVATIVE, PERYLENE DERIVATIVE OR SALT THEREOF, AND METHODS FOR PRODUCING SAME | 国立大学法人京都大学 (JP) | 2010-04-29 | — | — | WO | disclosed |