Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | EEF2K | O00418 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | CDC25A | P30304 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | RARG | P13631 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30928324 | 1.00 | NOTUM (0.46) | NOTUMKDM4ELMNASIGMAR1ALDH1A1 | |
| SCHEMBL10331082 | 1.00 | NOTUM (0.46) | NOTUMKDM4ELMNASIGMAR1ALDH1A1 | |
| SCHEMBL29402742 | 1.00 | NOTUM (0.46) | NOTUMKDM4ELMNASIGMAR1ALDH1A1 | |
| SCHEMBL1573643 | 0.98 | NOTUM (0.47) | NOTUMKDM4ELMNASIGMAR1ALDH1A1 | |
| SCHEMBL10331081 | 0.94 | NOTUM (0.49) | NOTUMSIGMAR1CNR2 | |
| SCHEMBL30564506 | 0.88 | RARB (0.37) | NOTUMKDM4ELMNASIGMAR1ALDH1A1 | |
| SCHEMBL28228519 | 0.87 | NOTUM (0.51) | NOTUMALDH1A1CYP1A2CYP2D6CNR2 | |
| Iodide SCHEMBL28254992 | 0.85 | NOTUM (0.50) | NOTUMALDH1A1CYP1A2CYP2D6CNR2 | |
| SCHEMBL29666963 | 0.81 | NOTUM (0.48) | NOTUMKDM4EALDH1A1CNR2MEN1 | |
| SCHEMBL5544189 | 0.81 | RARB (0.45) | KDM4ELMNASIGMAR1ALDH1A1CYP1A2 |
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-0738728-A2 | Ionic spiropyran compound and photochromic material conjugated it with clay | NISSHO IWAI BENTONITE CO.,LTD. (JP) | 1996-10-23 | — | — | EP | disclosed |