Known targets — ChEMBL curated mechanism
ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CHRM1CHRM2CHRM3CHRM4ESR1ESR2GABRA1GABRB1GABRG2GBA1HRH1HTR1DHTR2AOPRD1OPRK1OPRM1SLC6A2SLC6A3TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Mandelic Acid. 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 | |
|---|---|---|---|---|
| ▸ | ESR2 known ✓ | Q92731 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.86 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.86 |
| ▸ | CES2 | O00748 | 2/20 | 0.56 |
| ▸ | CES1 | P23141 | 2/20 | 0.56 |
| ▸ | SRC | P12931 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Mandelic Acid SCHEMBL29733052 | 0.95 | LMNA (0.95) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL21647917 | 0.93 | LMNA (1.00) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL165161 | 0.93 | LMNA (1.00) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL5313046 | 0.93 | LMNA (1.00) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL255601 | 0.93 | LMNA (1.00) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL1050 | 0.93 | LMNA (1.00) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL29777368 | 0.93 | LMNA (1.00) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL9185770 | 0.90 | LMNA (0.95) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL5202802 | 0.90 | LMNA (0.95) | LMNAMAPK1CES2CES1SRC | |
| Mandelic Acid SCHEMBL9051446 | 0.90 | LMNA (0.95) | LMNAMAPK1CES2CES1SRC |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108137616-A | Antibacterial agents comprising pyrazino [2,3-b ] [1,4] oxazin-3-ones or related ring systems | 葛兰素史克知识产权开发有限公司 | 2018-06-08 | — | — | CN | disclosed |
| EP-1116446-B1 | Method for improving shelf life and / or stability of products which may spoil by the influence of microbes | SCHUER JOERG-PETER (DE) | 2012-02-08 | — | — | EP | disclosed |
| EP-0991318-B1 | ADDITIVE FOR IMPROVING THE STORAGE LIFE OF AND/OR STABILISING MICROBIALLY PERISHABLE PRODUCTS | SCHUER JOERG-PETER (DE) | 2003-11-12 | — | — | EP | disclosed |
| EP-0762837-B1 | PROCESS FOR IMPROVING THE SHELF LIFE OF AND/OR STABILISING PRODUCTS WHICH CAN SPOIL UNDER THE ACTION OF MICROBES | SCHUER JOERG PETER PROF (DE) | 2002-02-27 | — | — | EP | disclosed |
| US-6277799-B1 | AQUEOUS MIXTURE OF SALT OF HYDROXYCARBOXYLIC ACID AND SURFACTANTS | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2001-08-21 | — | — | US | disclosed |
| EP-1116446-A2 | Method for improving shelf life and / or stability of products which may spoil by the influence of microbes | Schür, Jörg-Peter, Prof. (DE) | 2001-07-18 | — | — | EP | disclosed |
| EP-0991318-A1 | ADDITIVE FOR IMPROVING THE STORAGE LIFE OF AND/OR STABILISING MICROBIALLY PERISHABLE PRODUCTS | Schür, Jörg-Peter (DE) | 2000-04-12 | — | — | EP | disclosed |
| WO-1998058540-A1 | ADDITIVE FOR IMPROVING THE STORAGE LIFE OF AND/OR STABILISING MICROBIALLY PERISHABLE PRODUCTS | SCHUER JOERG PETER (DE) | 1998-12-30 | — | — | WO | disclosed |
| EP-0762837-A1 | PROCESS FOR IMPROVING THE SHELF LIFE OF AND/OR STABILISING PRODUCTS WHICH CAN SPOIL UNDER THE ACTION OF MICROBES | Schür, Jörg-Peter (DE) | 1997-03-19 | — | — | EP | disclosed |
| WO-1996029895-A1 | PROCESS FOR IMPROVING THE SHELF LIFE OF AND/OR STABILISING PRODUCTS WHICH CAN SPOIL UNDER THE ACTION OF MICROBES | SCHUER JOERG PETER (DE) | 1996-10-03 | — | — | WO | disclosed |