Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | ESRRA | P11474 | 1/20 | 0.32 |
| ▸ | FLT1 | P17948 | 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 | |
|---|---|---|---|---|
| SCHEMBL11270653 | 0.90 | HTT (0.40) | OPRD1OPRM1OPRK1HTTPPARG | |
| SCHEMBL11263214 | 0.87 | HTT (0.51) | HTTPPARGPPARDPPARAHPGD | |
| SCHEMBL11269796 | 0.84 | PPARD (0.36) | OPRK1HTTPPARGPPARDPPARA | |
| SCHEMBL11263206 | 0.84 | HCAR1 (0.42) | HTTNOTUMCYP11B2 | |
| SCHEMBL11268398 | 0.81 | ALDH1A1 (0.41) | HTTPPARGPPARDPPARA | |
| SCHEMBL11271704 | 0.80 | HTT (0.51) | HTTPPARGPPARDPPARACTSK | |
| SCHEMBL11275593 | 0.76 | SMN1; SMN2 (0.44) | NOTUMCYP11B2 | |
| SCHEMBL11264984 | 0.75 | KMT2A (0.39) | HTTPPARGPPARDPPARAHPGD | |
| SCHEMBL11271199 | 0.75 | PIM1 (0.35) | HTTPPARGPPARDPPARA | |
| SCHEMBL11267538 | 0.75 | CYP11B2 (0.32) | NOTUMCYP11B2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4350701-A | 1-(Trihalomethyl-sulfenyl)-4-aryl-1,2,4-triazolin-5-ones, and process for controlling fungi | BASF AKTIENGESELLSCHAFT (DE) | 1982-09-21 | — | — | US | disclosed |