Glutarate

Glutarate

SCHEMBL5875150

C1CNCCN1.C1CNCCN1.O=C(O)CCCC(=O)O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

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 0.65
LMNA P02545 4/20 0.56
TSHR P16473 4/20 0.53
NFKB1 P19838 2/20 0.53
PMP22 Q01453 1/20 0.53
CAMK2A Q9UQM7 1/20 0.48
ITGB3 P05106 1/20 0.46
ITGA2B P08514 1/20 0.46
GABRR3 A8MPY1 1/20 0.46
GABRP O00591 1/20 0.46
GABRD O14764 1/20 0.46
HDAC3 O15379 1/20 0.46
GABBR2 O75899 1/20 0.46
CYP1A2 P05177 1/20 0.46
THRB P10828 1/20 0.46
GABRA1 P14867 1/20 0.46
GABRB1 P18505 1/20 0.46
GABRG2 P18507 1/20 0.46
GABRR1 P24046 1/20 0.46
GABRB3 P28472 1/20 0.46

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 SCHEMBL5875165 1.00 SLC22A6 (0.65) SLC22A6LMNATSHRNFKB1PMP22
Adipic Acid SCHEMBL31163175 0.94 LMNA (0.65) SLC22A6LMNATSHRNFKB1PMP22
Adipic Acid SCHEMBL5875324 0.94 LMNA (0.65) SLC22A6LMNATSHRNFKB1PMP22
Adipic Acid SCHEMBL1642955 0.94 LMNA (0.65) SLC22A6LMNATSHRNFKB1PMP22
Piperazine SCHEMBL8581904 0.92 TSHR (0.67) SLC22A6LMNATSHRNFKB1PMP22
Sebacic Acid SCHEMBL5875109 0.92 TSHR (0.67) SLC22A6LMNATSHRNFKB1PMP22
Sebacic Acid SCHEMBL5875095 0.92 TSHR (0.67) SLC22A6LMNATSHRNFKB1PMP22
Adipic Acid SCHEMBL9949118 0.88 LMNA (0.65) SLC22A6LMNATSHRNFKB1PMP22
Piperazine SCHEMBL27772877 0.88 EGLN1 (0.50) SLC22A6LMNATSHRNFKB1PMP22
Glutarate SCHEMBL31031783 0.88 SLC22A6 (0.50) SLC22A6LMNATSHRNFKB1PMP22

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-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed