Edetic Acid

Edetic Acid

SCHEMBL840661

CC(=O)O.CC(=O)O.CC(=O)O.NCCN.O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Edetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A known ✓ P08913 1/20 0.64
TDP1 Q9NUW8 2/20 0.67
EYA2 O00167 1/20 0.67
APP P05067 1/20 0.67
ACE P12821 1/20 0.67
BLM P54132 2/20 0.64
PMP22 Q01453 2/20 0.64
KDM4E B2RXH2 1/20 0.64
LMNA P02545 1/20 0.64
CHRM2 P08172 1/20 0.64
ALOX15 P16050 1/20 0.64
TSHR P16473 1/20 0.64
DRD1 P21728 1/20 0.64
SLC6A2 P23975 1/20 0.64
SLC6A4 P31645 1/20 0.64
CYP2C19 P33261 1/20 0.64
ADRA1A P35348 1/20 0.64
DRD3 P35462 1/20 0.64
SLC6A3 Q01959 1/20 0.64
HRH3 Q9Y5N1 1/20 0.64

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.

Compoundsimilaritytop predictedshared targets
Edetic Acid SCHEMBL2557176 1.00 TDP1 (0.67) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL21793 1.00 TDP1 (0.67) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL10639072 1.00 TDP1 (0.67) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL3391953 1.00 TDP1 (0.67) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL1132175 0.98 TDP1 (0.64) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL5718746 0.98 TDP1 (0.64) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL489215 0.98 TDP1 (0.64) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL10706256 0.98 TDP1 (0.64) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL153915 0.94 TDP1 (0.58) TDP1EYA2APPACEBLM
Edetic Acid SCHEMBL3391944 0.94 TDP1 (0.58) TDP1EYA2APPACEBLM

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586086-B2 Hydrogel capable of containing and conveying cells POLITECNICO DI MILANO (IT) 2013-11-19 US disclosed
US-8143204-B2 Removal or prevention scale formation; using soluble magnesium salts; preinjection before evaporation ECOLAB USA INC. (US) 2012-03-27 US disclosed
US-20110236367-A1 RAT CATHESPIN DIPEPTIDYL PEPTIDASE I (DPPI): CRYSTAL STRUCTURE AND ITS USES TELENAV, INC. (US) 2011-09-29 US disclosed
US-20110189285-A1 HYDROGEL CAPABLE OF CONTAINING AND CONVEYING CELLS POLITECNICO DI MILANO (IT) 2011-08-04 US disclosed
WO-2011082064-A1 CHELATING AGENT MODIFIED GRAPHENE OXIDES, METHODS OF PREPARATION AND USE MONTCLAIR STATE UNIVERSITY (US) 2011-07-07 WO disclosed
US-7939498-B2 Cyclic peptides for preserving or enhancing the function of an organ allograft BRITISH CANADIAN BIOSCIENCES CORP. (CA) 2011-05-10 US disclosed
EP-2296616-A1 A PERSONAL WASH COMPOSITION Unilever N.V. (NL) 2011-03-23 EP disclosed
EP-2293775-A2 HYDROGEL CAPABLE OF CONTAINING AND CONVEYING CELLS Politecnico di Milano (IT) 2011-03-16 EP disclosed
WO-2009144569-A2 HYDROGEL CAPABLE OF CONTAINING AND CONVEYING CELLS POLITECNICO DI MILANO (IT) 2009-12-03 WO 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110236367-A1 RAT CATHESPIN DIPEPTIDYL PEPTIDASE I (DPPI): CRYSTAL STRUCTURE AND ITS USES DPP3, DPP7, DPP4 ADRA2A 4471/4885TDP1 1401/4885EYA2 3388/4885

“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.