Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 8/20 | 0.42 |
| ▸ | CASP2 | P42575 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL9635222 | 0.83 | AKR1B1 (0.46) | MEN1KMT2ACES2AKR1B1 | |
| Bicarbonate SCHEMBL28388669 | 0.81 | CES2 (0.48) | MEN1KMT2ACES2 | |
| SCHEMBL21244984 | 0.80 | CA3 (0.42) | MEN1KMT2A | |
| SCHEMBL11127322 | 0.79 | ALDH1A1 (0.44) | MEN1KMT2ACES2AKR1B1 | |
| SCHEMBL176011 | 0.78 | — | — | |
| Hexane SCHEMBL28335720 | 0.78 | EPHX1 (0.62) | EPHX1CASP2PLA2G2A | |
| SCHEMBL5489345 | 0.78 | SIGMAR1 (0.44) | — | |
| Hydrogen Peroxide SCHEMBL28990433 | 0.78 | TSHR (0.47) | CES2 | |
| Chloromethane SCHEMBL28123599 | 0.77 | EPHX1 (0.58) | EPHX1CASP2MEN1KMT2AL3MBTL1 | |
| SCHEMBL2440729 | 0.76 | EPHX1 (0.70) | EPHX1CASP2L3MBTL1PLA2G2A |
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-3880155-B1 | BIFUNCTIONAL AND POLYFUNCTIONAL COINITIATORS IN DENTAL COMPOSITIONS | DENTSPLY DETREY GMBH (DE) | 2023-12-27 | — | — | EP | disclosed |