Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HRAS | P01112 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | PPID | Q08752 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2178103 | 0.96 | CYP3A4 (0.48) | CYP3A4MAPTKDM4EHRASIDO1 | |
| Hydrochloric Acid SCHEMBL27547964 | 0.94 | MAPT (0.52) | CYP3A4MAPTKDM4EHRASIDO1 | |
| Water SCHEMBL27527749 | 0.94 | CYP3A4 (0.52) | CYP3A4MAPTKDM4EHRASIDO1 | |
| Chloromethane SCHEMBL27446335 | 0.92 | CYP3A4 (0.45) | CYP3A4MAPTKDM4EHRASIDO1 | |
| SCHEMBL28339272 | 0.86 | KCNH2 (0.43) | CYP3A4MAPTKDM4EHRASIDO1 | |
| Sulfuric Acid SCHEMBL27885484 | 0.85 | CA2 (0.46) | CYP3A4MAPTKDM4EHRASIDO1 | |
| Sulfuric Acid SCHEMBL27885483 | 0.85 | CA2 (0.46) | CYP3A4MAPTKDM4EHRASIDO1 | |
| Bicarbonate SCHEMBL28338933 | 0.83 | SMN1; SMN2 (0.46) | CYP3A4MAPTHRASMEN1KMT2A | |
| SCHEMBL21657636 | 0.82 | KDM4E (0.45) | CYP3A4MAPTKDM4EHRASIDO1 | |
| Benzaldehyde SCHEMBL7800457 | 0.82 | ALDH1A1 (0.47) | CYP3A4MAPTKDM4EHRASTHRB |
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-103073446-B | Preparation method of itopride hydrochloride | LIVZON SYNTPHARM CO LTD ZHUHAI FTZ | 2014-12-24 | — | — | CN | claimed |
| CN-103073446-B | Preparation method of itopride hydrochloride | LIVZON SYNTPHARM CO LTD ZHUHAI FTZ | 2014-12-24 | — | — | CN | disclosed |