SCHEMBL11296889

SCHEMBL11296889

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

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.40
DPP4 P27487 1/20 0.38
CPA1 P15085 1/20 0.38
CPA2 P48052 1/20 0.38
CPA4 Q9UI42 1/20 0.38
ANPEP P15144 5/20 0.36
DPP8 Q6V1X1 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
LAP3 P28838 5/20 0.33
MME P08473 3/20 0.33
ERAP1 Q9NZ08 2/20 0.33
NMT2 O60551 1/20 0.33
NMT1 P30419 1/20 0.33
IL1RN P18510 1/20 0.33
ERAP2 Q6P179 1/20 0.33
LNPEP Q9UIQ6 1/20 0.33
NOD1 Q9Y239 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
Alafosfalin SCHEMBL1582303 0.86 DPP4 (0.48) PAX8DPP4ANPEPDPP8DPP7
Alafosfalin SCHEMBL1582301 0.86 DPP4 (0.48) PAX8DPP4ANPEPDPP8DPP7
Alafosfalin SCHEMBL456724 0.86 DPP4 (0.48) PAX8DPP4ANPEPDPP8DPP7
Alafosfalin SCHEMBL11032329 0.86 DPP4 (0.48) PAX8DPP4ANPEPDPP8DPP7
SCHEMBL11303152 0.84 METAP1 (0.42) DPP4ANPEPDPP8DPP7LAP3
Alafosfalin SCHEMBL9619892 0.84 DPP4 (0.47) PAX8DPP4ANPEPDPP8DPP7
Alafosfalin SCHEMBL11297483 0.84 DPP4 (0.47) PAX8DPP4ANPEPDPP8DPP7
SCHEMBL30552905 0.79 MME (0.51) PAX8DPP4DPP8DPP7MME
SCHEMBL30452082 0.79 MME (0.51) PAX8DPP4DPP8DPP7MME
SCHEMBL11297402 0.79 ANPEP (0.40) DPP4ANPEPDPP8LAP3ERAP1

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