Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18322818 | 0.78 | ALOX5 (0.44) | LIPGEGFRMAPTTDP1KDM4E | |
| SCHEMBL28312974 | 0.78 | CYP19A1 (0.39) | TLR8CYP19A1MAOAMAOBGPR84 | |
| SCHEMBL28128701 | 0.77 | CYP19A1 (0.58) | CYP19A1MAOAMAOBMAPTKDM4E | |
| SCHEMBL27635492 | 0.75 | CYP19A1 (0.46) | TLR8CYP19A1MAOAMAOBEGFR | |
| SCHEMBL2356473 | 0.73 | BID (0.54) | LIPGMAPTKDM4EHSD17B10 | |
| SCHEMBL8770707 | 0.73 | TYR (0.48) | LIPGEGFRMAPTTDP1KDM4E | |
| SCHEMBL11352153 | 0.73 | LIPG (0.49) | LIPGEGFRCNR1MAPTTDP1 | |
| SCHEMBL28845923 | 0.73 | LIPG (0.49) | LIPGEGFRCNR1MAPTTDP1 | |
| (Z)-1,2-Diphenylethene SCHEMBL28882092 | 0.73 | RELA (0.54) | CYP19A1MAOAMAOBEGFRMAPT | |
| SCHEMBL27322505 | 0.72 | CYP19A1 (0.48) | CYP19A1MAOAMAOBMAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-100551916-C | New 2,4-diamino-1,3,5-triazines derivative | HAMARI CHEMICALS LTD (JP) | 2009-10-21 | — | — | CN | disclosed |
| CN-1726199-A | Novel 2,4-diamino-1,3,5-triazine derivative | HAMARI CHEMICALS LTD (JP) | 2006-01-25 | — | — | CN | disclosed |