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 | |
|---|---|---|---|---|
| ▸ | CA2 known ✓ | P00918 | 4/20 | 0.59 |
| ▸ | CA1 known ✓ | P00915 | 3/20 | 0.59 |
| ▸ | CA12 known ✓ | O43570 | 3/20 | 0.59 |
| ▸ | CA4 known ✓ | P22748 | 1/20 | 0.59 |
| ▸ | DHFR known ✓ | P00374 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | HTR6 | P50406 | 2/20 | 0.62 |
| ▸ | MPO | P05164 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CA9 | Q16790 | 4/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.59 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.59 |
| ▸ | AGO2 | Q9UKV8 | 2/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | CA6 | P23280 | 1/20 | 0.59 |
| ▸ | CA5A | P35218 | 1/20 | 0.59 |
| ▸ | CA7 | P43166 | 1/20 | 0.59 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL28999750 | 1.00 | TSHR (0.62) | TSHRLMNAHTR6MPOCYP3A4 | |
| SCHEMBL646075 | 1.00 | TSHR (0.62) | TSHRLMNAHTR6MPOCYP3A4 | |
| Water SCHEMBL2045997 | 0.97 | TSHR (0.59) | TSHRLMNAHTR6MPOCYP3A4 | |
| Potassium Ion SCHEMBL28275691 | 0.97 | TSHR (0.59) | TSHRLMNAHTR6MPOCYP3A4 | |
| SCHEMBL30460591 | 0.97 | TSHR (0.59) | TSHRLMNAHTR6MPOCYP3A4 | |
| Water SCHEMBL4384703 | 0.97 | TSHR (0.59) | TSHRLMNAHTR6MPOCYP3A4 | |
| Formaldehyde SCHEMBL9472914 | 0.95 | TSHR (0.56) | TSHRLMNAHTR6MPOCYP3A4 | |
| SCHEMBL2289878 | 0.94 | TSHR (0.62) | TSHRLMNAHTR6MPOCYP3A4 | |
| Potassium Ion SCHEMBL5776427 | 0.94 | TSHR (0.62) | TSHRLMNAHTR6MPOCYP3A4 | |
| Silver SCHEMBL30882004 | 0.94 | TSHR (0.62) | TSHRLMNAHTR6MPOCYP3A4 |
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-118996022-A | Organic leather tanning agent with covalent tanning characteristics, and preparation method and application thereof | 四川德赛尔新材料科技有限公司 | 2024-11-22 | — | — | CN | claimed |
| CN-106922707-B | Picarbitrazox-containing bactericidal composition, preparation and application thereof | 浙江新农化工股份有限公司 | 2022-07-12 | — | — | CN | disclosed |
| EP-1116778-A1 | A method for the anti-fouling treatment in petrochemical plants | CHIMEC S.P.A. (IT) | 2001-07-18 | — | — | EP | disclosed |