Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.32 |
| ▸ | SAT1 | P21673 | 2/20 | 0.31 |
| ▸ | KDM1A | O60341 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Diethanolamine SCHEMBL29148402 | 0.90 | FFAR3 (0.56) | FFAR3MEN1KMT2ATSHRHDAC3 | |
| Diethanolamine SCHEMBL1830524 | 0.90 | FFAR3 (0.56) | FFAR3MEN1KMT2ATSHRHDAC3 | |
| Acetic Acid SCHEMBL27210323 | 0.87 | CYP2C19 (0.39) | FFAR3MEN1KMT2ACYP2C19GLA | |
| Diethanolamine SCHEMBL27829119 | 0.87 | FFAR3 (0.53) | FFAR3MEN1KMT2ATSHRHDAC3 | |
| Bicarbonate SCHEMBL28204460 | 0.87 | CYP2C19 (0.39) | FFAR3MEN1KMT2ACYP2C19GLA | |
| Acetic Acid SCHEMBL8850209 | 0.87 | CYP2C19 (0.39) | FFAR3MEN1KMT2ACYP2C19GLA | |
| Propionic Acid SCHEMBL7115112 | 0.87 | FFAR3 (0.59) | FFAR3MEN1KMT2ACYP2C19GLA | |
| Glycine SCHEMBL9816937 | 0.86 | GLRA1 (0.46) | FFAR3MEN1KMT2ACYP2C19GLA | |
| Acetic Acid SCHEMBL28660785 | 0.85 | CYP2C19 (0.38) | FFAR3MEN1KMT2ACYP2C19GLA | |
| Acetic Acid SCHEMBL28324458 | 0.85 | CYP2C19 (0.38) | FFAR3MEN1KMT2ACYP2C19GLA |
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-107108594-A | 3 (chlorobenzene of 6 alkoxy 5 simultaneously [base of d] isoxazoles 3) propionic acid as kynurenine monooxygenase inhibitor | 葛兰素史密斯克莱知识产权发展有限公司 | 2017-08-29 | — | — | CN | disclosed |