Adipic Acid

Adipic Acid

SCHEMBL9995331

CCCCOCC(C)OCC(C)OCc1ccccc1.O=C(O)CCCCC(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC18A2SLC6A2SLC6A3

The experimentally established mechanism targets of Adipic 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
SLC6A3 known ✓ Q01959 1/20 0.38
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 2/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PLA2G4B P0C869 2/20 0.42
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TBXAS1 P24557 3/20 0.39
CETP P11597 3/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC3 O15379 1/20 0.38
ADRA1A P35348 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
Succinic Acid SCHEMBL9995351 0.96 ALDH1A1 (0.44) ALDH1A1MAPK1CYP3A4TSHRTDP1
Adipic Acid SCHEMBL9995098 0.89 MAPT (0.42) ALDH1A1MAPK1TSHRL3MBTL1MAPT
Adipic Acid SCHEMBL9995086 0.86 MAPT (0.44) ALDH1A1MAPK1MAPTRXFP1TBXAS1
Succinic Acid SCHEMBL9995221 0.83 TSHR (0.41) ALDH1A1TSHRL3MBTL1MEN1KMT2A
SCHEMBL22268995 0.82 TLR2 (0.42) TDP1L3MBTL1CETP
Succinic Acid SCHEMBL9995353 0.80 SLC1A3 (0.41) ALDH1A1MAPTHTTMEN1KMT2A
Adipic Acid SCHEMBL1409802 0.79 ALDH1A1 (0.51) ALDH1A1MAPK1CYP3A4TSHRTDP1
SCHEMBL2948589 0.79 TDP1 (0.46) ALDH1A1CYP3A4TSHRTDP1PLA2G4B
SCHEMBL2949128 0.79 TDP1 (0.46) ALDH1A1CYP3A4TSHRTDP1PLA2G4B
SCHEMBL17377702 0.78 RECQL (0.44) ALDH1A1TSHRTDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2202267-B1 Plasticizer for biodegradable aliphatic polyester resins, and biodegradable resin composition DAIHACHI CHEM IND (JP) 2011-12-07 EP claimed