SCHEMBL28111320

SCHEMBL28111320

C[C@H](N)C(=O)OP(=O)(O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
ALDH1A1 P00352 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 1/20 0.41
CA2 P00918 2/20 0.41
CA4 P22748 2/20 0.41
CA5A P35218 2/20 0.41
ANPEP P15144 3/20 0.40
LAP3 P28838 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
ERAP1 Q9NZ08 2/20 0.38
ERAP2 Q6P179 1/20 0.38

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
Aluminum Chloride Anhydrous SCHEMBL27515868 0.79 POLB (0.39) POLBALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL28864257 0.77 POLB (0.49) POLBALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL27762763 0.76 CA4 (0.48) POLBALDH1A1L3MBTL1TDP1TSHR
SCHEMBL28462158 0.76 CA2 (0.48) POLBALDH1A1L3MBTL1TSHRCA2
SCHEMBL3380600 0.75 POLB (0.40) POLBALDH1A1TDP1TSHRANPEP
SCHEMBL21050013 0.75 CA2 (0.52) POLBALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL27559223 0.73 ANPEP (0.48) ALDH1A1L3MBTL1TDP1ANPEPLAP3
SCHEMBL27559224 0.73 ANPEP (0.48) ALDH1A1L3MBTL1TDP1ANPEPLAP3
SCHEMBL8190038 0.73 ERAP1 (0.46) POLBALDH1A1TSHRANPEPLAP3
SCHEMBL28025783 0.72 POLB (0.53) POLBALDH1A1L3MBTL1KDM4ETSHR

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
CN-106117295-A Adefovirdipivoxil list sulfur is for L amino-acid ester list cholate derivant and preparation method thereof 贵州医科大学 2016-11-16 CN disclosed