Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.40 |
| ▸ | CES1 | P23141 | 3/20 | 0.40 |
| ▸ | F2R | P25116 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10747308 | 0.86 | CES2 (0.40) | CES2CES1F2RKEAP1PKM | |
| SCHEMBL10585954 | 0.82 | CES2 (0.57) | CES2CES1KEAP1ALDH1A1MDM2 | |
| SCHEMBL10803361 | 0.79 | CES2 (0.40) | CES2CES1KEAP1ANO1ALDH1A1 | |
| SCHEMBL5314369 | 0.79 | CES2 (0.57) | CES2CES1ALDH1A1NPC1MAPT | |
| SCHEMBL2916902 | 0.76 | HPGD (0.46) | CES2CES1PKMALDH1A1LMNA | |
| SCHEMBL7753673 | 0.74 | KMT2A (0.41) | ALDH1A1TP53NPC1MAPTRAB9A | |
| SCHEMBL221445 | 0.74 | KEAP1 (0.59) | CES2CES1F2RKEAP1PKM | |
| Methylene Chloride SCHEMBL4572767 | 0.72 | HPGD (0.43) | CES2CES1PKMALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL1372131 | 0.72 | KEAP1 (0.57) | CES2CES1F2RKEAP1PKM | |
| SCHEMBL9000270 | 0.72 | KEAP1 (0.57) | CES2CES1F2RKEAP1PKM |
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 |
|---|---|---|---|---|---|---|---|
| US-4533676-A | 2,5-Dihalogenobenzoyl-(thio)urea insecticides | BAYER AKTIENGESELLSCHAFT (DE) | 1985-08-06 | — | — | US | disclosed |
| EP-0093977-A1 | 2,5-Dihalogenbenzoyl ureas and thioureas, processes for their preparation and their use as pesticides | BAYER AG (DE) | 1983-11-16 | — | — | EP | disclosed |