SCHEMBL8832652

SCHEMBL8832652

NCCCC[C@H](N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O.[Cu]

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.44
SLC15A2 Q16348 1/20 0.41
MMP2 P08253 1/20 0.40
CD40 P25942 2/20 0.37
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35
ITGB3 P05106 2/20 0.35
ITGA2B P08514 2/20 0.35
GSR P00390 1/20 0.35
OPRM1 P35372 2/20 0.34
OPRD1 P41143 2/20 0.34
ERAP2 Q6P179 1/20 0.34
LNPEP Q9UIQ6 1/20 0.34

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
SCHEMBL2823387 0.99 TERT (0.44) TERTSLC15A2MMP2CD40GNAI3
SCHEMBL8832514 0.99 TERT (0.44) TERTSLC15A2MMP2CD40GNAI3
SCHEMBL4958851 0.93 SLC15A2 (0.50) TERTSLC15A2MMP2CD40OPRD1
SCHEMBL4958843 0.93 SLC15A2 (0.50) TERTSLC15A2MMP2CD40OPRD1
SCHEMBL9747810 0.91 SLC15A2 (0.46) TERTSLC15A2MMP2CD40OPRD1
SCHEMBL8427583 0.91 SLC15A2 (0.46) TERTSLC15A2MMP2CD40OPRD1
SCHEMBL9748489 0.91 SLC15A2 (0.46) TERTSLC15A2MMP2CD40OPRD1
SCHEMBL31453807 0.89 SLC15A2 (0.50) TERTSLC15A2CD40OPRM1OPRD1
SCHEMBL8832640 0.89 TERT (0.43) TERTSLC15A2MMP2CD40GNAI3
SCHEMBL31433209 0.89 SLC15A2 (0.45) TERTSLC15A2MMP2OPRM1OPRD1

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-5591711-A LYSINE-GLYCINE-HISTIDINE TRIPEPTIDE, FIBROBLAST PROLIFERATION HOECHST JAPAN LIMITED (JP) 1997-01-07 US disclosed