Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.31 |
| ▸ | P2RX2 | Q9UBL9 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4877753 | 0.76 | NOS3 (0.54) | NOS3NOS1NOS2PTPN1PTPN6 | |
| SCHEMBL10017418 | 0.72 | KMT2A (0.54) | NOS3NOS1NOS2PTPN1PTPN6 | |
| SCHEMBL510587 | 0.72 | PTPN1 (0.33) | NOS3NOS1NOS2PTPN1PTPN6 | |
| SCHEMBL1748895 | 0.72 | IDO1 (0.39) | NOS3NOS1NOS2PTPN1PTPN6 | |
| SCHEMBL9538187 | 0.71 | ACHE (0.32) | — | |
| SCHEMBL1479446 | 0.70 | — | — | |
| SCHEMBL2060131 | 0.69 | HTT (0.56) | PTPN1PTPN6PTPN11 | |
| SCHEMBL6488816 | 0.67 | MAP4K4 (0.44) | NOS3NOS1NOS2 | |
| SCHEMBL8018559 | 0.67 | EGFR (0.35) | — | |
| SCHEMBL27827705 | 0.65 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114437037-B | Compound containing pyridine-bis-triazole as well as preparation method and application thereof | 西安交通大学 | 2023-04-07 | — | — | CN | claimed |
| CN-114437037-A | Compound containing pyridine-bis-triazole as well as preparation method and application thereof | 西安交通大学 | 2022-05-06 | — | — | CN | claimed |
| CN-114437037-B | Compound containing pyridine-bis-triazole as well as preparation method and application thereof | 西安交通大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-114437037-A | Compound containing pyridine-bis-triazole as well as preparation method and application thereof | 西安交通大学 | 2022-05-06 | — | — | CN | disclosed |
| EP-1725544-A1 | 3-[4-HETEROCYCLYL-1,2,3-TRIAZOL-1-YL]-N-ARYL-BENZAMIDES AS INHIBITORS OF THE CYTOKINES PRODUCTION FOR THE TREATMENT OF CHRONIC INFLAMMATORY DISEASES | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2006-11-29 | — | — | EP | disclosed |
| WO-2005090333-A1 | 3-‘4-HETEROCYCLYL -1,2,3,-TRIAZOL-1-YL!-N-ARYL-BENZAMIDES AS INHIBITORS OF THE CYTOKINES PRODUCTION FOR THE TREATMENT OF CHRONIC INFLAMMATORY DISEASES | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2005-09-29 | — | — | WO | disclosed |