Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | GRM8 | O00222 | 1/20 | 0.36 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MBOAT4 | Q96T53 | 5/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GALR3 | O60755 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ENPP1 | P22413 | 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 | |
|---|---|---|---|---|
| SCHEMBL5593234 | 0.91 | CYP1A2 (0.41) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 | |
| SCHEMBL5593079 | 0.91 | SMN1; SMN2 (0.33) | CYP1A2SMN1; SMN2HTTLMNAMBOAT4 | |
| SCHEMBL5593340 | 0.91 | CYP1A2 (0.39) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 | |
| SCHEMBL5593211 | 0.90 | MBOAT4 (0.38) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 | |
| SCHEMBL5593140 | 0.88 | CYP1A2 (0.35) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 | |
| SCHEMBL5593367 | 0.83 | SMN1; SMN2 (0.36) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 | |
| SCHEMBL5593091 | 0.81 | CYP1A2 (0.43) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 | |
| SCHEMBL5593248 | 0.81 | MBOAT4 (0.36) | CYP1A2SMN1; SMN2HTTLMNAMBOAT4 | |
| SCHEMBL5593329 | 0.80 | MBOAT4 (0.40) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 | |
| SCHEMBL5593503 | 0.80 | CYP1A2 (0.38) | CYP1A2GRM8GRM7GRM4SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007099092-A1 | SUBSTITUTED 6-PHENYL-7-AMINO[1,2,4]-TRIAZOLO[1,5-a]PYRIMIDINES AND THEIR USE FOR CONTROLLING PATHOGENIC FUNGI | BASF SE (DE) | 2007-09-07 | — | — | WO | disclosed |