Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.31 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9528033 | 0.78 | SIRT1 (0.44) | XDHSIRT1KCNH2CNR1CNR2 | |
| SCHEMBL8105628 | 0.77 | PDE4A (0.42) | TLR7ADORA3ADORA2AADORA1 | |
| SCHEMBL13585976 | 0.76 | AGTR1 (0.39) | SIRT1CYP1A2CYP2C9CYP2C19AGTR1 | |
| SCHEMBL8259928 | 0.72 | SIRT1 (0.49) | XDHSIRT1SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL14394352 | 0.71 | AGTR1 (0.41) | SIRT1AGTR1AGTR2 | |
| SCHEMBL92739 | 0.69 | KCNH2 (0.46) | KCNH2GPR84SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL13714538 | 0.68 | SIRT1 (0.36) | XDHSIRT1CNR1CNR2ALDH1A1 | |
| SCHEMBL7711334 | 0.67 | KCNH2 (0.50) | KCNH2GPR84SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL31054446 | 0.67 | KCNH2 (0.50) | KCNH2GPR84SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL29523323 | 0.67 | KCNH2 (0.50) | KCNH2GPR84SMN1; SMN2ALDH1A1LMNA |
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-0527851-A1 | 1H-SUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1993-02-24 | — | — | EP | disclosed |
| WO-1991017148-A1 | 1H-SUBSTITUTED-1,2,4-TRIAZOLE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1991-11-14 | — | — | WO | disclosed |