Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | GSTP1 | P09211 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 5/20 | 0.51 |
| ▸ | MGAM | O43451 | 4/20 | 0.51 |
| ▸ | SI | P14410 | 4/20 | 0.51 |
| ▸ | MGAM2 | Q2M2H8 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13021506 | 0.81 | MAOB (0.56) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL18411548 | 0.80 | GAA (0.65) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL28262364 | 0.78 | GAA (0.54) | CYP1A2CYP2C19GAAMAPTMAPK1 | |
| SCHEMBL7775902 | 0.76 | CYP1A2 (0.60) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL50524 | 0.76 | CYP1A2 (0.55) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL254671 | 0.76 | LMNA (0.88) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL24448850 | 0.76 | ALOX5 (0.51) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL21617280 | 0.76 | MAOB (0.53) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL10000684 | 0.76 | LMNA (0.69) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 | |
| SCHEMBL8668267 | 0.76 | LMNA (0.59) | CYP1A2LMNAPTGS1SLC6A2CYP2C19 |
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-103130626-A | Preparation method of 3- tertiary butyl-2 and 5- dyhydroxy- benzaldehyde | SHENYANG RES INST OF THE PHOTOGRAPHIC MATERIALS & CHEMICAL INDUSTRY | 2013-06-05 | — | — | CN | claimed |