Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3845472 | 0.92 | HTR6 (0.44) | HTR6HTR2CACHESLC22A12TBXAS1 | |
| SCHEMBL3864275 | 0.90 | MAOA (0.44) | HTR6HTR2CACHESLC22A12TBXAS1 | |
| SCHEMBL3840597 | 0.84 | CYP4F2 (0.45) | SLC22A12TBXAS1CYP1A2CYP2C19PPARG | |
| SCHEMBL6361178 | 0.83 | HTR6 (0.46) | HTR6HTR2CACHETAAR1DRD2 | |
| SCHEMBL5333496 | 0.81 | TBXAS1 (0.51) | TAAR1SLC22A12CYP2A6HTR2ASMN1; SMN2 | |
| SCHEMBL27347338 | 0.74 | SLC22A12 (0.43) | ACHESLC22A12SMN1; SMN2TBXAS1PPARG | |
| SCHEMBL3381395 | 0.74 | CA12 (0.41) | SLC22A12SMN1; SMN2TBXAS1CYP1A2PPARA | |
| Hydrochloric Acid SCHEMBL4884079 | 0.73 | TBXAS1 (0.55) | NOS1SLC22A12SMN1; SMN2LOXL2TBXAS1 | |
| SCHEMBL3840925 | 0.73 | PPARA (0.47) | SLC22A12SMN1; SMN2PPARA | |
| SCHEMBL3150010 | 0.73 | SLC22A12 (0.50) | SLC22A12TBXAS1PPARGPPARA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1856065-B1 | 1,2,4-TRIAZINE DERIVATIVES, PREPARATION AND USE THEREOF IN HUMAN THERAPY | PF MEDICAMENT (FR) | 2009-11-11 | — | — | EP | disclosed |