Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.47 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | GSTA1 | P08263 | 1/20 | 0.47 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.47 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | MAP2K6 | P52564 | 1/20 | 0.47 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.47 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.47 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11264009 | 0.90 | CYP2C9 (0.49) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL11259800 | 0.87 | CYP2C9 (0.47) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| Hydrochloric Acid SCHEMBL11269895 | 0.86 | HPGD (0.43) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| Hydrochloric Acid SCHEMBL11257724 | 0.85 | CYP2C9 (0.49) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL11256277 | 0.84 | CYP2C9 (0.52) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL11265896 | 0.83 | CYP2C9 (0.54) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL11266552 | 0.81 | CYP2C9 (0.45) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL11543646 | 0.78 | CYP2C9 (0.56) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| Hydrochloric Acid SCHEMBL11272266 | 0.78 | ALDH1A1 (0.42) | CYP2C9ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL11138212 | 0.78 | CYP2C9 (0.59) | CYP2C9ALDH1A1MEN1KMT2ATSHR |
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-4323691-A | Hydroxyaminomethyl derivatives of benzoyl di-substituted α-phenoxyalkanoyl esters | ABBOTT LABORATORIES (US) | 1982-04-06 | — | — | US | disclosed |