Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | PADI1 | Q9ULC6 | 3/20 | 0.35 |
| ▸ | PADI3 | Q9ULW8 | 3/20 | 0.35 |
| ▸ | PADI4 | Q9UM07 | 3/20 | 0.35 |
| ▸ | PADI2 | Q9Y2J8 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1850628 | 1.00 | CNR2 (0.41) | CNR2ACP3MAOBSIRT2SIRT1 | |
| Hydrochloric Acid SCHEMBL3805598 | 0.99 | CNR2 (0.40) | CNR2ACP3MAOBSIRT2SIRT1 | |
| SCHEMBL12462316 | 0.87 | CNR2 (0.42) | CNR2ACP3MAOBSIRT2SIRT1 | |
| SCHEMBL719784 | 0.87 | CNR2 (0.45) | CNR2ACP3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL3696793 | 0.87 | CNR2 (0.45) | CNR2ACP3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL195361 | 0.87 | CNR2 (0.42) | CNR2ACP3MAOBCACNA2D1CACNA1B | |
| Hydrochloric Acid SCHEMBL195363 | 0.86 | CNR2 (0.44) | CNR2ACP3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL6017225 | 0.86 | CYP1A2 (0.43) | CNR2ACP3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13457707 | 0.83 | CNR2 (0.39) | CNR2ACP3CACNA2D1CACNA1BCACNB1 | |
| SCHEMBL194961 | 0.83 | RAB9A (0.38) | CNR2CYP1A2CYP2C19MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010098496-A1 | PROCESS FOR PRODUCING TETRAHYDROTRIAZOLOPYRIDINE DERIVATIVE | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-09-02 | — | — | WO | claimed |
| WO-2010098496-A1 | PROCESS FOR PRODUCING TETRAHYDROTRIAZOLOPYRIDINE DERIVATIVE | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-09-02 | — | — | WO | disclosed |
| WO-2010098496-A1 | PROCESS FOR PRODUCING TETRAHYDROTRIAZOLOPYRIDINE DERIVATIVE | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-09-02 | — | — | WO | disclosed |