Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1962107 | 1.00 | CYP2C19 (0.42) | CYP2C19KDM4EUSP2ALDH1A1HPGD | |
| SCHEMBL29664191 | 0.82 | MEN1 (0.32) | MEN1OPRK1HTTKMT2A | |
| SCHEMBL2014165 | 0.80 | AKR1C3 (0.33) | — | |
| SCHEMBL1962123 | 0.76 | CYP4F2 (0.34) | KDM4EALDH1A1HPGDHSD17B10CFD | |
| SCHEMBL17043258 | 0.75 | — | — | |
| SCHEMBL1962777 | 0.71 | MAPT (0.42) | CYP2C19CYP3A4CYP2D6NPSR1MEN1 | |
| SCHEMBL6113940 | 0.69 | PTGS2 (0.31) | — | |
| SCHEMBL2183270 | 0.67 | CYP2C19 (0.60) | CYP2C19KDM4EUSP2ALDH1A1HPGD | |
| SCHEMBL1814669 | 0.66 | HTT (0.43) | KDM4EALDH1A1HPGDHSD17B10BACE1 | |
| SCHEMBL27781530 | 0.66 | KDM4E (0.77) | CYP2C19KDM4EUSP2ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-107253943-B | Photochromic compounds and compositions | 光学转变公司 | 2022-05-17 | — | — | CN | disclosed |