Alanine

Alanine

SCHEMBL21144329

CCCC[P+](CCCC)(CCCC)CCCN.C[C@H](N)C(=O)[O-]

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.46
CA2 P00918 4/20 0.44
SLC15A1 P46059 1/20 0.43
DPP7 Q9UHL4 6/20 0.43
DPP8 Q6V1X1 5/20 0.43
DPP9 Q86TI2 4/20 0.43
DPP4 P27487 1/20 0.43
DNM1 Q05193 2/20 0.40
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SPHK1 Q9NYA1 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
Alanine SCHEMBL16289673 0.92 CA1 (0.52) CA1CA2SLC15A1DPP7DPP8
Glycine SCHEMBL21144375 0.85 CA2 (0.44) CA1CA2DPP7DPP8DPP9
Lysine SCHEMBL29168874 0.82 DPP7 (0.50) CA1CA2SLC15A1DPP7DPP8
SCHEMBL29712227 0.79 DNM1 (0.60) DPP7DPP8DPP9DPP4DNM1
Valine SCHEMBL18575000 0.79 CA1 (0.47) CA1CA2SLC15A1DPP7DPP8
Valine SCHEMBL18575002 0.79 CA1 (0.47) CA1CA2SLC15A1DPP7DPP8
L-Lactic Acid SCHEMBL668437 0.78 CA1 (0.54) CA1CA2DNM1CYP3A4TSHR
Glycine SCHEMBL3684638 0.78 CA2 (0.48) CA1CA2DNM1NFKB1
Bromide SCHEMBL21591924 0.77 DNM1 (0.62) DPP7DPP8DPP9DPP4DNM1
Bicarbonate SCHEMBL1685163 0.77 DNM1 (0.57) CA1CA2DNM1CYP3A4TSHR

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-20210394935-A1 Omnidirectional Electrostatic Thruster KENDALL CHRISTIAN (US) 2021-12-23 US disclosed
US-20190217972-A1 Omnidirectional Electrostatic Thruster KENDALL CHRISTIAN (US) 2019-07-18 US disclosed