Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | IDO1 | P14902 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 2/20 | 0.36 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28167406 | 0.80 | RAB9A (0.42) | CYP3A4CYP2C9CYP2C19CYP1A2MAPK1 | |
| SCHEMBL4095951 | 0.80 | CYP2A6 (0.41) | CYP3A4CYP2C9CYP2C19CYP1A2MAPK1 | |
| SCHEMBL29070042 | 0.74 | KEAP1 (0.46) | CYP2C9ALDH1A1MAPT | |
| SCHEMBL3787206 | 0.73 | CCR2 (0.46) | CYP3A4CYP2C9CYP2C19MAPK1RAB9A | |
| SCHEMBL1145559 | 0.72 | TP53 (0.48) | CYP3A4CYP2C9CYP2C19CYP1A2RAB9A | |
| SCHEMBL18850253 | 0.70 | CCR2 (0.46) | CYP3A4CYP2C9CYP2C19RAB9AALDH1A1 | |
| SCHEMBL8492853 | 0.70 | CYP3A4 (0.48) | CYP3A4CYP2C9CYP2C19RAB9AALDH1A1 | |
| SCHEMBL22411226 | 0.69 | HPGD (0.42) | CYP3A4CYP2C9CYP2C19MAPK1RAB9A | |
| SCHEMBL30548387 | 0.69 | HPGD (0.42) | CYP3A4CYP2C9CYP2C19MAPK1RAB9A | |
| SCHEMBL3783594 | 0.68 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP2C19CYP1A2MAPK1 |
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-1987004-A2 | SUBSTITUTED PYRIDINEAMIDE COMPOUNDS USEFUL AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS | Boehringer Ingelheim International GmbH (DE) | 2008-11-05 | — | — | EP | disclosed |
| WO-2007098352-A2 | SUBSTITUTED PYRIDINEAMIDE COMPOUNDS USEFUL AS SOLUBLE EPOXIDE HYDROLASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-08-30 | — | — | WO | disclosed |