Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Benomyl. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.94 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.94 |
| ▸ | ASAH1 | Q13510 | 8/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.43 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Benomyl SCHEMBL29379464 | 0.97 | TSHR (1.00) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| Benomyl SCHEMBL8379451 | 0.97 | TSHR (1.00) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| Benomyl SCHEMBL15681 | 0.97 | TSHR (1.00) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| Benomyl SCHEMBL28721488 | 0.96 | TSHR (0.94) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| Benomyl SCHEMBL3962065 | 0.96 | TSHR (0.98) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| Benomyl SCHEMBL6912357 | 0.95 | TSHR (0.92) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| Benomyl SCHEMBL23632884 | 0.93 | TSHR (0.92) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| Benomyl SCHEMBL28422686 | 0.93 | TSHR (0.92) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| SCHEMBL9578770 | 0.92 | TSHR (0.91) | TSHRALDH1A1ASAH1NPSR1KDM4E | |
| SCHEMBL205803 | 0.90 | TSHR (0.87) | TSHRALDH1A1ASAH1NPSR1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1942442-B | Insecticidal N-substituted sulfenimides | DOW AGROSCIENCES LLC | 2012-10-31 | — | — | CN | disclosed |
| CN-101648906-B | Insecticidal N-substituted sulfoximines | DOW AGROSCIENCES LLC | 2012-07-11 | — | — | CN | disclosed |
| CN-102264224-A | Stable sulfenimide insecticide compositions | — | 2011-11-30 | — | — | CN | disclosed |