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 | 2/20 | 0.56 |
| ▸ | CA1 known ✓ | P00915 | 2/20 | 0.53 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2123674 | 1.00 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 | |
| SCHEMBL25301056 | 1.00 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 | |
| SCHEMBL459856 | 0.91 | FABP3 (0.50) | CA2CA1NPSR1RECQLMAPT | |
| Potassium Ion SCHEMBL1094530 | 0.87 | FABP3 (0.53) | NPSR1RECQLMAPTEPHX2BLM | |
| SCHEMBL247523 | 0.85 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 | |
| SCHEMBL2123672 | 0.85 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 | |
| SCHEMBL8022640 | 0.85 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 | |
| SCHEMBL11699305 | 0.85 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 | |
| SCHEMBL66700 | 0.85 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 | |
| SCHEMBL30424973 | 0.85 | CA2 (0.56) | CA2CA1GPR84NFKB1FFAR1 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110754485-A | Efficient slow-release low-residue bactericide for vegetables and preparation method thereof | 陈永福 | 2020-02-07 | — | — | CN | claimed |
| CN-113143950-B | Pharmaceutical composition for treating liver diseases and application thereof | 河北医科大学第二医院 | 2023-04-18 | — | — | CN | disclosed |
| CN-112716945-B | Pharmaceutical composition and application thereof | 河北医科大学 | 2022-11-15 | — | — | CN | disclosed |
| CN-113143950-A | Pharmaceutical composition for treating liver diseases and application thereof | 河北医科大学第二医院 | 2021-07-23 | — | — | CN | disclosed |
| CN-112716945-A | Pharmaceutical composition and application thereof | 河北医科大学 | 2021-04-30 | — | — | CN | disclosed |
| CN-110754485-A | Efficient slow-release low-residue bactericide for vegetables and preparation method thereof | 陈永福 | 2020-02-07 | — | — | CN | disclosed |
| US-20140128299-A1 | AMINE-FREE VOC-FREE METAL WORKING FLUID | CHEMETALL GMBH (DE) | 2014-05-08 | — | — | US | disclosed |
| EP-2705128-A1 | AMINE-FREE VOC-FREE METAL WORKING FLUID | Chemetall GmbH (DE) | 2014-03-12 | — | — | EP | disclosed |
| WO-2012152639-A1 | AMINE-FREE VOC-FREE METAL WORKING FLUID | CHEMETALL GMBH (DE) | 2012-11-15 | — | — | WO | disclosed |
| US-20100204324-A1 | Optically Active N-(Alpha-Mercaptopropionyl)Glycine | NANJING SANHOME PHARMACEUTICAL CO., LTD. (CN) | 2010-08-12 | — | — | US | disclosed |
| EP-2181984-A1 | AN OPTICALLY ACTIVE N- (alpha-MERCAPTOPROPIONY) GLYCINE | Nanjing Sanhome Pharmaceutical Co., Ltd. (CN) | 2010-05-05 | — | — | EP | disclosed |
| US-4336307-A | MELT SPINNING WITH A ORGANIC ALKALI OR ALKALINE EARTH METAL SULFONATE PORE FORMING AGENT | TEIJIN LIMITED (JP) | 1982-06-22 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100204324-A1 | Optically Active N-(Alpha-Mercaptopropionyl)Glycine | GNMT, MGST1, GSTP1 | CA2 3353/4885CA1 3251/4885GPR84 1257/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.