Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GNAI3 | P08754 | 2/20 | 0.32 |
| ▸ | GNAO1 | P09471 | 2/20 | 0.32 |
| ▸ | GNAI1 | P63096 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | CXCR4 | P61073 | 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 | |
|---|---|---|---|---|
| SCHEMBL28057902 | 0.92 | KDM4E (0.46) | KDM4EALDH1A1SMN1; SMN2HTTKMT2A | |
| SCHEMBL13724865 | 0.90 | KDM4E (0.45) | KDM4EALDH1A1SMN1; SMN2HTTKMT2A | |
| SCHEMBL27876270 | 0.89 | KDM4E (0.44) | KDM4EALDH1A1SMN1; SMN2HTTKMT2A | |
| SCHEMBL28183858 | 0.89 | KDM4E (0.44) | KDM4EALDH1A1SMN1; SMN2HTTKMT2A | |
| SCHEMBL21177824 | 0.85 | ALDH1A1 (0.44) | KDM4EALDH1A1SMN1; SMN2HTTKMT2A | |
| SCHEMBL28057903 | 0.72 | LMNA (0.46) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL12745050 | 0.71 | — | — | |
| SCHEMBL15670916 | 0.71 | CXCR4 (0.45) | KDM4EALDH1A1GNAI3GNAO1GNAI1 | |
| Hydrochloric Acid SCHEMBL1462517 | 0.70 | KDM4E (0.43) | KDM4EALDH1A1SMN1; SMN2HTTKMT2A | |
| SCHEMBL28057908 | 0.69 | — | — |
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-101597196-B | Improved drug candidate and preparation method thereof | JIYAKETA CO., LTD. (CH) | 2016-05-04 | — | — | CN | disclosed |