Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 7/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 3/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL7615380 | 0.72 | CYP11B1 (0.31) | CYP11B1CYP11B2 | |
| SCHEMBL19744126 | 0.71 | PDE3B (0.31) | NOTUMCYP1A2 | |
| SCHEMBL1966360 | 0.70 | P2RX7 (0.36) | NOTUM | |
| SCHEMBL7967372 | 0.70 | KIF11 (0.49) | CYP11B1CYP11B2 | |
| SCHEMBL1274798 | 0.70 | HSD11B1 (0.42) | KMOCYP1A2GRM2 | |
| SCHEMBL1041026 | 0.69 | ESR2 (0.52) | KMOCYP1A2FAAHARCYP11B2 | |
| SCHEMBL7281497 | 0.67 | AHR (0.52) | KMONOTUM | |
| SCHEMBL7803250 | 0.67 | KIF11 (0.41) | NOTUM | |
| SCHEMBL15090399 | 0.67 | KIF11 (0.49) | KMODAONOTUMFAAHTRPV3 | |
| SCHEMBL7699908 | 0.66 | AHR (0.45) | NOTUMAKR1C3AKR1C2AR |
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-2001092236-A1 | 4-ALKYL HALIDE TRIAZINE COMPOUNDS USED AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2001-12-06 | — | — | WO | disclosed |