Cyclohexylglycyl

Cyclohexylglycyl

SCHEMBL7937138

N[C@@H]1CCCCC1CC(=O)O.N[C@H](C(=O)O)C1CCCCC1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 3/20 0.43
SLC6A11 P48066 3/20 0.43
SLC6A13 Q9NSD5 3/20 0.43
DPP4 P27487 7/20 0.41
ALDH1A1 P00352 1/20 0.39
GRM2 Q14416 1/20 0.36
SLC1A2 P43004 4/20 0.36
SLC1A1 P43005 4/20 0.36
SLC1A3 P43003 2/20 0.36
GLS O94925 1/20 0.35

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
SCHEMBL3742078 0.83 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13ALDH1A1GRM2
SCHEMBL7410374 0.83 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13ALDH1A1GRM2
SCHEMBL7739796 0.79 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2
SCHEMBL30445198 0.79 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2
SCHEMBL3109773 0.79 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2
SCHEMBL7740219 0.79 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2
SCHEMBL7739792 0.79 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2
SCHEMBL7740218 0.79 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2
SCHEMBL24316913 0.79 DPP4 (0.57) DPP4ALDH1A1GRM2SLC1A2SLC1A1
SCHEMBL21977981 0.79 DPP4 (0.57) DPP4ALDH1A1GRM2SLC1A2SLC1A1

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-6235707-B1 Anticoagulant peptidyl-arginine aldehyde derivatives GYOGYSZERKUTATO INTEZET KFT. (HU) 2001-05-22 US disclosed