Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14715635 | 0.96 | CYP1A2 (0.35) | CYP1A2CYP2D6CA1CA2CA9 | |
| SCHEMBL14715597 | 0.74 | — | — | |
| SCHEMBL12681500 | 0.72 | CYP1A2 (0.50) | CYP1A2CYP2D6CA1CA2CA9 | |
| SCHEMBL5400910 | 0.65 | CYP1A2 (0.39) | CYP1A2CYP2D6POLBALDH1A1KMT2A | |
| SCHEMBL10841659 | 0.64 | CYP1A2 (0.48) | CYP1A2CYP2D6CA1CA2CA9 | |
| SCHEMBL13261204 | 0.64 | MAPT (0.49) | CA1CA2CA9POLBALDH1A1 | |
| SCHEMBL54507 | 0.63 | KMT2A (0.47) | CYP1A2CYP2D6CA1CA2CA9 | |
| SCHEMBL4889415 | 0.63 | CYP1A2 (0.43) | CYP1A2CYP2D6CA1CA2CA9 | |
| SCHEMBL10507012 | 0.63 | CA1 (0.36) | CYP1A2CYP2D6CA1CA2CA9 | |
| SCHEMBL9622242 | 0.63 | KMT2A (0.37) | CYP1A2CYP2D6CA1CA2CA9 |
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-2251392-B1 | AGENT FOR RELEASING FUNCTIONAL SUBSTANCE | KAO CORP (JP) | 2013-02-27 | — | — | EP | disclosed |