SCHEMBL3094791

SCHEMBL3094791

NC(=O)C(CSSCC(N)C(=O)O)NCP(=O)(O)O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLUL P15104 1/20 0.35
NOS2 P35228 3/20 0.35
NOS1 P29475 2/20 0.35
NOS3 P29474 1/20 0.35
BHMT Q93088 1/20 0.34
OTC P00480 1/20 0.34
MME P08473 1/20 0.33
ECE1 P42892 1/20 0.33
ARG1 P05089 1/20 0.32
ARG2 P78540 1/20 0.32

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
SCHEMBL2990989 0.91 GLUL (0.37) GLULBHMTOTCMMEECE1
SCHEMBL2990974 0.91 GLUL (0.37) GLULBHMTOTCMMEECE1
SCHEMBL2990982 0.91 GLUL (0.37) GLULBHMTOTCMMEECE1
Aspartic Acid SCHEMBL7745094 0.77 CA2 (0.41) GLUL
Cystine SCHEMBL30234178 0.76 GLUL (0.44) GLULNOS2NOS1NOS3BHMT
SCHEMBL2983747 0.74 BHMT (0.48) GLULNOS2NOS1NOS3BHMT
SCHEMBL2983738 0.74 BHMT (0.48) GLULNOS2NOS1NOS3BHMT
SCHEMBL27743691 0.74 BHMT (0.48) GLULNOS2NOS1NOS3BHMT
SCHEMBL17749411 0.73 NOS2 (0.44) NOS2NOS1NOS3ARG1ARG2
SCHEMBL9703082 0.72 NOS2 (0.47) NOS2NOS1NOS3BHMTARG1

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-20100247463-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2010-09-30 US claimed