Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Carbaril. 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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.90 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.90 |
| ▸ | PGR | P06401 | 1/20 | 0.90 |
| ▸ | GAA | P10253 | 1/20 | 0.90 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.90 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.90 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | PLK1 | P53350 | 1/20 | 0.47 |
| ▸ | FABP7 | O15540 | 4/20 | 0.47 |
| ▸ | FABP3 | P05413 | 4/20 | 0.47 |
| ▸ | FABP5 | Q01469 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Carbaril SCHEMBL1006235 | 0.95 | ALDH1A1 (0.93) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL374307 | 0.95 | ALDH1A1 (1.00) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL29370871 | 0.95 | ALDH1A1 (1.00) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL26737 | 0.95 | ALDH1A1 (1.00) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL7529862 | 0.94 | ALDH1A1 (0.90) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL9515092 | 0.93 | ALDH1A1 (0.97) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL2426561 | 0.93 | ALDH1A1 (0.97) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL2521354 | 0.93 | ALDH1A1 (0.97) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL3474939 | 0.93 | ALDH1A1 (0.97) | ALDH1A1HSD17B10PGRGAAPTGS1 | |
| Carbaril SCHEMBL6054746 | 0.93 | ALDH1A1 (0.97) | ALDH1A1HSD17B10PGRGAAPTGS1 |
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-2010011787-A1 | PEST-CONTROL COMPOSITIONS AND METHODS HAVING HIGH TARGET AND LOW NON-TARGET ACTIVITY | TYRATECH, INC. (US) | 2010-01-28 | — | — | WO | disclosed |