Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5205307 | 0.84 | SMN1; SMN2 (0.45) | KDM4EMAPTSMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL10585221 | 0.81 | SMN1; SMN2 (0.59) | MAPTSMN1; SMN2L3MBTL1ALDH1A1LMNA | |
| SCHEMBL5207846 | 0.72 | PTGS2 (0.62) | SMN1; SMN2 | |
| SCHEMBL5201569 | 0.71 | PTGS2 (0.62) | CYP2C9 | |
| SCHEMBL8510766 | 0.71 | SMN1; SMN2 (0.47) | SMN1; SMN2CYP1A2CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL3353902 | 0.70 | PTGS2 (0.60) | CYP2C9 | |
| SCHEMBL4533395 | 0.70 | PTGS2 (0.46) | KDM4EMAPTSMN1; SMN2L3MBTL1HSD17B10 | |
| SCHEMBL5201918 | 0.70 | MAPK13 (0.46) | SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL5202645 | 0.70 | PTGS2 (0.53) | KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1 | |
| SCHEMBL5203715 | 0.70 | LMNA (0.43) | KDM4EMAPTHSD17B10ALDH1A1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1458706-A4 | DIARYL 1,2,4-TRIAZOLE DERIVATIVES AS A HIGHLY SELECTIVE CYCLOOXYGENASE-2 INHIBITOR | CJ CORP (KR) | 2005-06-08 | — | — | EP | disclosed |
| EP-1458706-A1 | DIARYL 1,2,4-TRIAZOLE DERIVATIVES AS A HIGHLY SELECTIVE CYCLOOXYGENASE-2 INHIBITOR | CJ Corp. (KR) | 2004-09-22 | — | — | EP | disclosed |
| WO-2003055875-A1 | DIARYL 1,2,4-TRIAZOLE DERIVATIVES AS A HIGHLY SELECTIVE CYCLOOXYGENASE-2 INHIBITOR | CJ CORP. (KR) | 2003-07-10 | — | — | WO | disclosed |