Adipic Acid

Adipic Acid

SCHEMBL3220731

Cc1ccc(C(N)=O)c(C)c1.N.O=C(O)CCCCC(=O)O

nearest known ligand 0.55

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
TSHR P16473 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 2/20 0.49
GAA P10253 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 1/20 0.42
FABP4 P15090 1/20 0.42
HSD11B1 P28845 1/20 0.42
HTT P42858 2/20 0.41
NFE2L2 Q16236 1/20 0.41
HDAC3 O15379 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL284479 0.84 MKNK1 (0.49) KMT2AMEN1SMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL27585323 0.82 MKNK1 (0.47) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL14032006 0.81 KMT2A (0.62) TSHRKMT2AMEN1GAASMN1; SMN2
Adipic Acid SCHEMBL4456880 0.80 KMT2A (0.56) TSHRKMT2AMEN1SMN1; SMN2NPC1
Adipic Acid SCHEMBL27952557 0.79 TSHR (0.64) TSHRKMT2AMEN1GAASMN1; SMN2
SCHEMBL5679029 0.78 PARP1 (0.50) SMN1; SMN2NPC1RAB9AALDH1A1NFE2L2
SCHEMBL10618681 0.77 SMN1; SMN2 (0.44) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL3519350 0.76 KMT2A (0.74) TSHRKMT2AMEN1GAASMN1; SMN2
SCHEMBL31661658 0.76 KMT2A (0.74) TSHRKMT2AMEN1GAASMN1; SMN2
SCHEMBL18675955 0.75 TSHR (0.59) TSHRKMT2AMEN1GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100057052-A1 Medical Catheter Tube KANEKA CORPORATION (JP) 2010-03-04 US disclosed
EP-2080535-A1 CATHETER TUBE FOR MEDICAL USE Kaneka Corporation (JP) 2009-07-22 EP disclosed