SCHEMBL8377692

SCHEMBL8377692

C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N(c1ccccc1)[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.40
ACE P12821 11/20 0.39
F2 P00734 1/20 0.37
ACE2 Q9BYF1 4/20 0.36
ERAP2 Q6P179 1/20 0.36
ERAP1 Q9NZ08 1/20 0.36
LNPEP Q9UIQ6 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRK1 P41145 2/20 0.36
EPHA2 P29317 1/20 0.36

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
Sulfuric Acid SCHEMBL9554342 0.85 DPP4 (0.37) DPP4ACEF2ACE2OPRM1
SCHEMBL7270568 0.85 ERAP2 (0.43) DPP4ACEF2ERAP2ERAP1
Arginine SCHEMBL7270509 0.80 ERAP2 (0.40) DPP4ACEACE2ERAP2ERAP1
Arginine SCHEMBL7264392 0.79 ERAP2 (0.44) DPP4ACEERAP2ERAP1LNPEP
Arginine SCHEMBL7270329 0.79 EPHA2 (0.40) DPP4ACEERAP2ERAP1LNPEP
SCHEMBL7263949 0.79 DPP4 (0.40) DPP4ACEF2ERAP2ERAP1
Arginine SCHEMBL7264233 0.78 ERAP2 (0.41) DPP4ACEERAP2ERAP1LNPEP
Arginine SCHEMBL7264440 0.78 ERAP2 (0.41) DPP4ACEERAP2ERAP1LNPEP
SCHEMBL27492704 0.78 ALDH1A1 (0.37)
Arginine SCHEMBL7271463 0.77 ERAP2 (0.40) DPP4ACEERAP2ERAP1LNPEP

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
EP-0664786-B1 ARGININE KETO-AMIDE ENZYME INHIBITORS CORVAS INT INC (US) 1999-03-24 EP disclosed