Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2D | O15399 | 1/20 | 0.44 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | UNG | P13051 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.38 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.38 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.38 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.38 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.37 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.37 |
| ▸ | TRIM33 | Q9UPN9 | 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 | |
|---|---|---|---|---|
| SCHEMBL7066405 | 0.84 | MAOB (0.40) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL13475717 | 0.80 | RAB9A (0.47) | ALDH1A1HCAR2CYP2A6KDM4EKDM2B | |
| SCHEMBL6551318 | 0.80 | GRIN2D (0.57) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL691707 | 0.80 | ALDH1A1 (0.63) | ALDH1A1HCAR2UNGKDM4ETSHR | |
| SCHEMBL31428506 | 0.80 | GRIN2D (0.57) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL30196606 | 0.80 | ALDH1A1 (0.63) | ALDH1A1HCAR2UNGKDM4ETSHR | |
| 4-Methylbenzoic Acid SCHEMBL7126317 | 0.78 | ALDH1A1 (0.61) | ALDH1A1SRD5A2CYP2A6KDM4ESMN1; SMN2 | |
| SCHEMBL12213020 | 0.77 | ALDH1A1 (0.59) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL12213019 | 0.77 | ALDH1A1 (0.59) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 | |
| SCHEMBL12213021 | 0.77 | ALDH1A1 (0.59) | GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20030077768-A1 | Use of xylene monooxygenase for the oxidation of substituted polycyclic aromatic compounds | E.I. DU PONT DE NEMOURS AND COMPANY | 2003-04-24 | — | — | US | disclosed |