Glutarate

Glutarate

SCHEMBL29536271

O=C(O)CCC(=O)O.O=C(O)CCC(=O)O.O=C(O)CCCC(=O)O

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1CDK4CDK6CHRM2CHRM3DPP4DRD2DRD3DRD4EGFRHRH1HTR1BHTR1DHTR1FHTR2AHTR2CHTR4SLC6A2SLC6A4

The experimentally established mechanism targets of Glutarate. 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
SLC22A6 Q4U2R8 2/20 0.92
LMNA P02545 5/20 0.77
EGLN1 Q9GZT9 2/20 0.75
ALKBH5 Q6P6C2 1/20 0.75
SUCNR1 Q9BXA5 1/20 0.75
TSHR P16473 4/20 0.71
NFKB1 P19838 2/20 0.71
PMP22 Q01453 1/20 0.71
CAMK2A Q9UQM7 1/20 0.62
HDAC11 Q96DB2 2/20 0.59
GABRR3 A8MPY1 1/20 0.59
GABRP O00591 1/20 0.59
GABRD O14764 1/20 0.59
HDAC3 O15379 1/20 0.59
GABBR2 O75899 1/20 0.59
CYP1A2 P05177 1/20 0.59
THRB P10828 1/20 0.59
GABRA1 P14867 1/20 0.59
GABRB1 P18505 1/20 0.59
GABRG2 P18507 1/20 0.59

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
Glutarate SCHEMBL1602467 1.00 SLC22A6 (0.92) SLC22A6LMNAEGLN1ALKBH5SUCNR1
Glutarate SCHEMBL28947728 0.96 SLC22A6 (0.85) SLC22A6LMNAEGLN1ALKBH5SUCNR1
Adipic Acid SCHEMBL2333828 0.96 LMNA (0.85) SLC22A6LMNAEGLN1ALKBH5SUCNR1
Adipic Acid SCHEMBL2480632 0.96 LMNA (0.85) SLC22A6LMNAEGLN1ALKBH5SUCNR1
Adipic Acid SCHEMBL10002678 0.96 LMNA (0.85) SLC22A6LMNAEGLN1ALKBH5SUCNR1
Glutarate SCHEMBL28811854 0.96 SLC22A6 (0.85) SLC22A6LMNAEGLN1ALKBH5SUCNR1
Glutarate SCHEMBL6701735 0.96
Glutarate SCHEMBL27601182 0.96 SLC22A6 (1.00) SLC22A6LMNAEGLN1ALKBH5SUCNR1
Glutarate SCHEMBL7414 0.96
Glutarate SCHEMBL158774 0.96 SLC22A6 (1.00) SLC22A6LMNAEGLN1ALKBH5SUCNR1

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
CN-115583992-A Carrier protein with redox response and application thereof in preparation of vaccine 江南大学 2023-01-10 CN disclosed
CN-112089832-B Hapten-modified carrier protein and application thereof in preparation of vaccine 江南大学 2022-04-22 CN disclosed