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 | |
|---|---|---|---|---|
| ▸ | CA12 known ✓ | O43570 | 5/20 | 0.61 |
| ▸ | CA2 known ✓ | P00918 | 5/20 | 0.61 |
| ▸ | CA1 known ✓ | P00915 | 4/20 | 0.61 |
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.50 |
| ▸ | CA4 known ✓ | P22748 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | RECQL | P46063 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8418962 | 0.80 | CA12 (0.67) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL19953365 | 0.79 | LMNA (0.55) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL2017578 | 0.78 | CA12 (0.64) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL3521509 | 0.76 | CA2 (1.00) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL513540 | 0.76 | CA2 (0.64) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL13110661 | 0.76 | SMN1; SMN2 (0.64) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL5575093 | 0.76 | CA12 (0.61) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL35747 | 0.76 | ALDH1A1 (0.61) | CA12CA2CA1ALDH1A1CA9 | |
| Hydrochloric Acid SCHEMBL28024787 | 0.76 | CA12 (0.61) | CA12CA2CA1ALDH1A1CA9 | |
| SCHEMBL9175160 | 0.76 | ALDH1A1 (0.61) | CA12CA2CA1ALDH1A1CA9 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115558357-A | Environment-friendly water-based paint and preparation method thereof | 安徽韩铝环保新材料有限公司 | 2023-01-03 | — | — | CN | claimed |
| CN-115354379-A | High-temperature nickel-free hole sealing agent and hole sealing process | 安徽韩铝环保新材料有限公司 | 2022-11-18 | — | — | CN | claimed |
| CN-115558357-A | Environment-friendly water-based paint and preparation method thereof | 安徽韩铝环保新材料有限公司 | 2023-01-03 | — | — | CN | disclosed |
| CN-115354379-A | High-temperature nickel-free hole sealing agent and hole sealing process | 安徽韩铝环保新材料有限公司 | 2022-11-18 | — | — | CN | disclosed |
| CN-112881311-A | Creatine kinase detection reagent, kit and detection method | 深圳迈瑞生物医疗电子股份有限公司 | 2021-06-01 | — | — | CN | disclosed |
| US-5395886-A | Modified fluorohydrocarbon polymers | DOW CORNING CORPORATION (US) | 1995-03-07 | — | — | US | disclosed |
| US-5367023-A | Modified fluorohydrocarbon polymers | DOW CORNING CORPORATION (US) | 1994-11-22 | — | — | US | disclosed |
| EP-0507468-A2 | Modified fluorohydrocarbon polymers | DOW CORNING CORPORATION (US) | 1992-10-07 | — | — | EP | disclosed |