Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 5/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.37 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.37 |
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21257763 | 0.88 | ALDH1A1 (0.36) | SLC6A2SLC6A4ALDH1A1L3MBTL1SRD5A1 | |
| SCHEMBL21257758 | 0.72 | NOTUM (0.38) | ALDH1A1NOTUMSRD5A1KMT2A | |
| SCHEMBL21257761 | 0.72 | CYP3A4 (0.40) | GAA | |
| SCHEMBL8228638 | 0.72 | DPP9 (0.47) | SLC6A2SLC6A4ALDH1A1L3MBTL1SLC6A3 | |
| SCHEMBL21257797 | 0.70 | MEN1 (0.43) | SLC6A2SLC6A4NOTUMDPP8DPP9 | |
| SCHEMBL21257764 | 0.69 | CYP3A4 (0.38) | — | |
| SCHEMBL21257792 | 0.69 | AADAT (0.36) | SLC6A2SLC6A4NOTUMSLC6A3MEN1 | |
| SCHEMBL8999096 | 0.68 | TRIM24 (0.49) | ALDH1A1NOTUMSRD5A1MEN1GAA | |
| SCHEMBL28114020 | 0.67 | SRD5A1 (0.59) | NOTUMSRD5A1 | |
| SCHEMBL11863634 | 0.66 | BRD4 (0.41) | ALDH1A1L3MBTL1NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019154261-A1 | PYRIDINE DERIVATIVE RELATED TO KMD5 PATHWAY | 南京明德新药研发股份有限公司 | 2019-08-15 | — | — | WO | disclosed |