SCHEMBL11297402

SCHEMBL11297402

C[C@H](NC(=O)[C@@H](N)CO)P(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 5/20 0.40
LAP3 P28838 5/20 0.36
ERAP1 Q9NZ08 1/20 0.36
PDCD1LG2 Q9BQ51 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
DPP4 P27487 2/20 0.34
DPP8 Q6V1X1 2/20 0.34
DPP9 Q86TI2 2/20 0.34
METAP1 P53582 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL11298340 0.93 ANPEP (0.36) ANPEPLAP3ERAP1PDCD1LG2CD274
SCHEMBL11292280 0.85 DPP4 (0.44) ANPEPLAP3ERAP1DPP4DPP8
SCHEMBL18946364 0.83 ANPEP (0.39) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL18919526 0.83 ANPEP (0.39) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL11569050 0.83 ANPEP (0.39) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL11569051 0.83 ANPEP (0.39) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL1582293 0.83 ANPEP (0.48) ANPEPLAP3ERAP1MMP1MMP8
SCHEMBL11373398 0.81 DPP8 (0.49) ANPEPLAP3DPP4DPP8DPP9
SCHEMBL11288716 0.81 DPP8 (0.49) ANPEPLAP3DPP4DPP8DPP9
SCHEMBL11128452 0.80 S1PR2 (0.37) ANPEPLAP3ERAP1CA12CA1

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-4250085-A PHOSPHONATE-CONTAINING OLIGOPEPTIDES, BACTERICIDES HOFFMANN-LA ROCHE INC. (US) 1981-02-10 US disclosed