Glutarate

Glutarate

SCHEMBL8628217

NCC(=O)O.O=C(O)CCCC(=O)O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.46

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Known targets — ChEMBL curated mechanism

SLC5A2

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
NOS2 P35228 2/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
ARG1 P05089 2/20 0.39
PRCP P42785 2/20 0.38
BLM P54132 2/20 0.37
KMT2A Q03164 2/20 0.37
GLI1 P08151 1/20 0.37
MEN1 O00255 1/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
GABRR3 A8MPY1 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
HDAC3 O15379 1/20 0.36
GABBR2 O75899 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
Adipic Acid SCHEMBL16915301 0.91 ARG1 (0.41) NOS2ARG1PRCPBLMKMT2A
Adipic Acid SCHEMBL16915303 0.91 ARG1 (0.41) NOS2ARG1PRCPBLMKMT2A
Proline SCHEMBL419844 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM
Proline SCHEMBL1125864 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM
Proline SCHEMBL302681 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM
Proline SCHEMBL302680 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM
Proline SCHEMBL3097543 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM
D-Proline SCHEMBL18493080 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM
Proline SCHEMBL1675389 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM
Proline SCHEMBL418934 0.91 NOS2 (0.45) NOS2NOS3NOS1PRCPBLM

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
US-5710252-A GENETIC ENGINEERING AND POLYPEPTIDES EASTMAN KODAK COMPANY (US) 1998-01-20 US disclosed