Aceglumate

Aceglumate

SCHEMBL21055962

CC(=O)NC(CCC(=O)O)C(=O)O.CSCCC(N)C(=O)O.N=C(N)NCCCC(N)C(=O)O.N=C(N)NCCCC(N)C(=O)O.NC(=O)CCC(N)C(=O)O.NC(CCC(=O)O)C(=O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACES1PR1S1PR4S1PR5

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

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 12/20 0.42
FNTB P49356 12/20 0.42
PGGT1B P53609 10/20 0.42
FOLH1 Q04609 1/20 0.42
NOD1 Q9Y239 5/20 0.39
ALOX15 P16050 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
KMT2A Q03164 1/20 0.37

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
Aceglumate SCHEMBL28885877 1.00 FNTA (0.42) FNTAFNTBPGGT1BFOLH1NOD1
Aceglumate SCHEMBL28443403 1.00 FNTA (0.42) FNTAFNTBPGGT1BFOLH1NOD1
Acetylglutamic Acid SCHEMBL365384 1.00 FNTA (0.42) FNTAFNTBPGGT1BFOLH1NOD1
Arginine SCHEMBL4059260 0.91 ALOX15 (0.45) FNTAFNTBPGGT1BFOLH1NOD1
Arginine SCHEMBL458502 0.91 ALOX15 (0.45) FNTAFNTBPGGT1BFOLH1NOD1
Arginine SCHEMBL6668510 0.88 FOLH1 (0.51) FOLH1NOD1KMT2A
Arginine SCHEMBL18660568 0.87 ALOX15 (0.49) FNTAFNTBPGGT1BNOD1ALOX15
Arginine SCHEMBL6517506 0.87 ALOX15 (0.49) FNTAFNTBPGGT1BNOD1ALOX15
Arginine SCHEMBL4052601 0.87 ALOX15 (0.49) FNTAFNTBPGGT1BNOD1ALOX15
SCHEMBL30463274 0.87 FOLH1 (0.46) FNTAFNTBPGGT1BFOLH1

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-3271012-B1 DEVICES FOR PROVIDING SKIN CARE USING PHOTOTHERAPY INDERM (FR) 2019-06-19 EP claimed