Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL140015 | 0.79 | RELA (0.54) | ALDH1A1KDM4EL3MBTL1RELANQO2 | |
| SCHEMBL9227634 | 0.79 | RELA (0.50) | ALDH1A1KDM4EL3MBTL1RELANQO2 | |
| SCHEMBL6320160 | 0.76 | TYR (0.39) | ALDH1A1HTR2ACYP2A6 | |
| SCHEMBL7498639 | 0.76 | RELA (0.50) | ALDH1A1KDM4EL3MBTL1RELANQO2 | |
| SCHEMBL8326846 | 0.75 | RELA (0.46) | ALDH1A1KDM4EL3MBTL1RELAPTGS1 | |
| SCHEMBL543436 | 0.74 | HTR2A (0.47) | ALDH1A1L3MBTL1HTR2ACYP2A6 | |
| SCHEMBL8735737 | 0.74 | ALDH1A1 (0.50) | ALDH1A1KDM4EL3MBTL1RELANQO2 | |
| SCHEMBL7854496 | 0.74 | RELA (0.52) | ALDH1A1KDM4EL3MBTL1RELANQO2 | |
| SCHEMBL7805362 | 0.74 | RELA (0.52) | ALDH1A1KDM4EL3MBTL1RELANQO2 | |
| SCHEMBL9527298 | 0.74 | RELA (0.52) | ALDH1A1KDM4EL3MBTL1RELANQO2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1165515-A1 | PYRIDINE-2,3-DICARBOXYLIC ACID DIAMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000058288-A1 | PYRIDINE-2,3-DICARBOXYLIC ACID DIAMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2000-10-05 | — | — | WO | disclosed |