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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.40 |
| ▸ | CA4 known ✓ | P22748 | 1/20 | 0.40 |
| ▸ | PPARG known ✓ | P37231 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL692135 | 0.81 | CYP1A2 (0.46) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| SCHEMBL8584192 | 0.81 | CYP1A2 (0.41) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| SCHEMBL27597867 | 0.81 | PPARA (0.41) | CA2CA4CYP1A2MEN1KMT2A | |
| Phosphine SCHEMBL27522539 | 0.79 | CYP1A2 (0.45) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| Ammonia Solution, Strong SCHEMBL27869910 | 0.79 | CYP1A2 (0.45) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| SCHEMBL11851064 | 0.79 | CYP1A2 (0.40) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| SCHEMBL28107544 | 0.79 | CYP1A2 (0.45) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| Water SCHEMBL28856009 | 0.79 | CYP1A2 (0.45) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| SCHEMBL28219394 | 0.79 | CYP1A2 (0.45) | CYP1A2MEN1KMT2AALDH1A1ALOX15 | |
| SCHEMBL6003069 | 0.78 | LTA4H (0.41) | CA2CA4CYP1A2MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115583879-A | Production process and system of high-concentration 2,4-sodium dropwise salt | 安徽兴隆化工有限公司 | 2023-01-10 | — | — | CN | claimed |
| CN-114041467-B | Preparation method of super absorbent resin for inhibiting weed growth, sterilizing and promoting crop growth | 潍坊科技学院 | 2023-07-28 | — | — | CN | disclosed |
| CN-115583879-A | Production process and system of high-concentration 2,4-sodium dropwise salt | 安徽兴隆化工有限公司 | 2023-01-10 | — | — | CN | disclosed |
| CN-113115772-B | Slow-release pesticide with expanded perlite as carrier and preparation method thereof | 仲恺农业工程学院 | 2022-12-20 | — | — | CN | disclosed |
| CN-115460925-A | Herbicidal mentha plant extract compositions and methods of use thereof | 哈普生物除草剂解决方案公司 | 2022-12-09 | — | — | CN | disclosed |