Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16944266 | 0.82 | POLB (0.42) | CYP2C9CYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL26031153 | 0.79 | CYP3A4 (0.47) | CYP2C9CYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL13647554 | 0.77 | ALDH1A1 (0.39) | CYP2C9CYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL26031157 | 0.77 | MAOB (0.48) | CYP2C9CYP1A2CYP2C19CYP3A4ALDH1A1 | |
| SCHEMBL28030309 | 0.75 | CYP19A1 (0.43) | CYP2C9CYP1A2CYP2C19CYP3A4ADORA2A | |
| SCHEMBL18394604 | 0.74 | MYC (0.54) | CYP2C9CYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL25541370 | 0.73 | GRM7 (0.44) | CYP2C9CYP1A2CYP2C19CYP3A4POLB | |
| Cyanide SCHEMBL27958675 | 0.73 | SMN1; SMN2 (0.41) | CYP2C9CYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL1610077 | 0.73 | KDM4E (0.41) | CYP2C9CYP1A2CYP2C19CYP3A4KDM4E | |
| SCHEMBL1613624 | 0.71 | S1PR3 (0.47) | CYP2C9CYP1A2CYP2C19CYP3A4KDM4E |
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 148 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106243131-A | 1,4 dimethyl 2,5 2 1H 1,2,4 couples triazole copper nitrate two dimension complex monocrystal and application | 天津师范大学 | 2016-12-21 | — | — | CN | claimed |
| CN-105859750-A | 1,4-dimethyl-2,5-bis-1H-double-triazole pyromellitic acid copper complex single crystal and application thereof | 天津师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-105859755-A | 1,4-dimethyl-2,5-di-1H-1,2,4-bis (triazol 1 yl) isophthalic acid cadmium complex single crystal and application | 天津师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-105859753-A | 1,4-dimethyl-2,5-di-1H-1,2,4-bis (triazol 1 yl) three-dimensional zinc complex single crystal and application | 天津师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-105859751-A | 1,4-dimethyl-2,5-di-1H-1,2,4-bis (triazol 1 yl) terephthalic acid copper complex single crystal and application | 天津师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-105859754-A | 1,4-dimethyl-2,5-bis-1H-1,2,4-double-triazole zinc mixed complex single crystal and application thereof | 天津师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-105859786-A | 1,4-dimethyl-2,5-di-1H-1,2,4-bis (triazol 1 yl) 5-methylisophthalic acid manganese complex single crystal and application | 天津师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-105859756-A | 1,4-dimethyl-2,5-di-1H-1,2,4-bis (triazol 1 yl) cadmium mixed-ligand complex single crystal and application | 天津师范大学 | 2016-08-17 | — | — | CN | claimed |
| CN-105837603-A | 1,4-dimethyl-2,5-di-1H-1,2,4-bistriazolylbiphenyldicarboxylic acid copper complex monocrystal and application thereof | 天津师范大学 | 2016-08-10 | — | — | CN | claimed |
| CN-105837605-A | 1, 4-dimethyl-2, 5-bi-1H-1, 2, 4-bis (triazol 1 yl) two-dimensional copper complex single crystal and application | 天津师范大学 | 2016-08-10 | — | — | CN | claimed |
| CN-105503914-A | Triazole isophthalic acid cadmium complex single crystal and preparation method and application thereof | UNIV TIANJIN | 2016-04-20 | — | — | CN | claimed |
| CN-105503910-A | 1, 4-dimethyl-2, 5-dimethylene bis triazole two-dimensional zinc m-phthalate complex single crystal and application | UNIV TIANJIN | 2016-04-20 | — | — | CN | claimed |
| CN-105503913-A | 1, 4-dimethyl-2, 5-dimethylene bis triazole cadmium terephthalate complex single crystal and application | UNIV TIANJIN | 2016-04-20 | — | — | CN | claimed |
| CN-105418688-A | 1,4-dimethyl-2,5-dimethylene bis triazol three-dimensional nickel complex single crystal and application | UNIV TIANJIN | 2016-03-23 | — | — | CN | claimed |
| CN-105418657-A | 1,4-dimethyl-2,5-dimethylene bis(triazole)isophthalic acid-included dimethylacetamide cadimium complex single crystal and application | UNIV TIANJIN | 2016-03-23 | — | — | CN | claimed |
| CN-105418660-A | 1,4-dimethyl-2,5-dimethylene bis(triazole)cadimium complex single crystal and application | UNIV TIANJIN | 2016-03-23 | — | — | CN | claimed |
| CN-105418654-A | 1,4-dimethyl-2,5-dimethylene bis(triazole) 5-methyl isophthalic acid cadimium complex single crystal and application | UNIV TIANJIN | 2016-03-23 | — | — | CN | claimed |
| CN-105418523-A | 1,4-dimethyl-2,5-dimethylene bis(triazole)terephthalic acid single crystal and application | UNIV TIANJIN | 2016-03-23 | — | — | CN | claimed |
| CN-105418658-A | 1,4-dimethyl-2,5-dimethylene bis triazol one-dimensional cadmium complex single crystal and application | UNIV TIANJIN | 2016-03-23 | — | — | CN | claimed |
| CN-105418659-A | 1,4-dimethyl-2,5-dimethylene bis triazol hydroxyphenylacetic isophthalic acid cadmium complex single crystal and application | UNIV TIANJIN | 2016-03-23 | — | — | CN | claimed |