Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| ▸ | CA1 known ✓ | P00915 | 2/20 | 0.46 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.45 |
| ▸ | FABP3 | P05413 | 7/20 | 0.47 |
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL326732 | 0.80 | EPHX2 (0.49) | FABP3CA1CA2FAAH | |
| SCHEMBL1724240 | 0.77 | FABP3 (0.47) | FABP3CA1FAAHFFAR1FFAR4 | |
| SCHEMBL28626709 | 0.77 | CA2 (0.76) | FABP3CA1CA2FAAHGMNN | |
| SCHEMBL9132842 | 0.77 | CA2 (0.76) | FABP3CA1CA2FAAHGMNN | |
| SCHEMBL11273293 | 0.77 | CA2 (0.76) | FABP3CA1CA2FAAHGMNN | |
| SCHEMBL8678511 | 0.77 | CA2 (0.76) | FABP3CA1CA2FAAHGMNN | |
| SCHEMBL11273289 | 0.77 | CA2 (0.76) | FABP3CA1CA2FAAHGMNN | |
| SCHEMBL11273298 | 0.77 | CA2 (0.76) | FABP3CA1CA2FAAHGMNN | |
| SCHEMBL28362946 | 0.77 | CA2 (0.76) | FABP3CA1CA2FAAHGMNN | |
| Idroxioleic Acid SCHEMBL2230289 | 0.75 | FABP3 (0.56) | FABP3CA1CA2FAAHFFAR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107494559-B | Insecticidal composition for preventing and controlling citrus leaf miner and application thereof | 浙江农林大学 | 2020-09-29 | — | — | CN | disclosed |
| CN-107509735-B | Synergistic acaricidal composition and use thereof | 浙江农林大学 | 2020-09-11 | — | — | CN | disclosed |
| CN-111602664-A | Slow-release rice seedbed treating agent containing bactericidal active composition and application thereof | 上海贯发海洋生物科技有限公司 | 2020-09-01 | — | — | CN | disclosed |
| CN-106508917-B | Slow-release bactericidal insecticide and application thereof | 中国中化股份有限公司 | 2020-03-24 | — | — | CN | disclosed |
| CN-110583668-A | Mite-killing pesticide composition and application thereof | 浙江工业大学 | 2019-12-20 | — | — | CN | disclosed |
| CN-110558326-A | Pesticide composition and application thereof | 浙江工业大学 | 2019-12-13 | — | — | CN | disclosed |