Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 6/20 | 0.65 |
| ▸ | LTA4H | P09960 | 1/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.54 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.54 |
| ▸ | MMP12 | P39900 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10085324 | 0.87 | BCHE (0.68) | BCHELTA4HEPHX2SIGMAR1FFAR1 | |
| SCHEMBL585331 | 0.84 | TSHR (0.47) | CYP1A2CYP2C19 | |
| SCHEMBL8855301 | 0.84 | BCHE (0.65) | BCHELTA4HEPHX2SIGMAR1FFAR1 | |
| SCHEMBL8855308 | 0.84 | BCHE (0.65) | BCHELTA4HEPHX2SIGMAR1FFAR1 | |
| SCHEMBL10565984 | 0.84 | BCHE (0.65) | BCHELTA4HEPHX2SIGMAR1FFAR1 | |
| Hydrochloric Acid SCHEMBL11483001 | 0.83 | BCHE (0.63) | BCHELTA4HEPHX2SIGMAR1FFAR1 | |
| Hydrochloric Acid SCHEMBL8855338 | 0.83 | BCHE (0.63) | BCHELTA4HEPHX2SIGMAR1FFAR1 | |
| SCHEMBL25309034 | 0.81 | BCHE (0.74) | BCHESIGMAR1 | |
| SCHEMBL28686580 | 0.81 | BCHE (0.61) | BCHELTA4HEPHX2SIGMAR1FFAR1 | |
| Hydrochloric Acid SCHEMBL9734448 | 0.80 | BCHE (0.67) | BCHELTA4HEPHX2SIGMAR1FFAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105061172-A | Synthetic method for 2-hydroxyl-5-(3-methoxyl propyl) benzaldehyde | XI AN RUILIAN MODERN ELECTRONIC CHEMICALS CO LTD | 2015-11-18 | — | — | CN | claimed |
| CN-105061172-A | Synthetic method for 2-hydroxyl-5-(3-methoxyl propyl) benzaldehyde | XI AN RUILIAN MODERN ELECTRONIC CHEMICALS CO LTD | 2015-11-18 | — | — | CN | disclosed |