SCHEMBL28294788

SCHEMBL28294788

NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O.[Zn]

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.59
FOLH1 Q04609 1/20 0.57
NAALAD2 Q9Y3Q0 1/20 0.57
CA1 P00915 3/20 0.54
CA2 P00918 3/20 0.54
MME P08473 4/20 0.53
CPA1 P15085 1/20 0.52
ACE2 Q9BYF1 1/20 0.52
SLC7A5 Q01650 1/20 0.51
ITGB3 P05106 2/20 0.50
ITGA2B P08514 2/20 0.50
EPHX2 P34913 1/20 0.48
CHRNA1 P02708 1/20 0.48
CHRNG P07510 1/20 0.48
CHRNB1 P11230 1/20 0.48
CHRND Q07001 1/20 0.48

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
SCHEMBL28294791 1.00 ACE (0.59) ACEFOLH1NAALAD2CA1CA2
SCHEMBL479126 0.98 ACE (0.60) ACEFOLH1NAALAD2CA1CA2
SCHEMBL479125 0.98 ACE (0.60) ACEFOLH1NAALAD2CA1CA2
SCHEMBL7110134 0.98 ACE (0.60) ACEFOLH1NAALAD2CA1CA2
SCHEMBL7110125 0.98 ACE (0.60) ACEFOLH1NAALAD2CA1CA2
SCHEMBL3459805 0.98 ACE (0.60) ACEFOLH1NAALAD2CA1CA2
Water SCHEMBL7103036 0.97 ACE (0.59) ACEFOLH1NAALAD2CA1CA2
Water SCHEMBL22150379 0.97 ACE (0.59) ACEFOLH1NAALAD2CA1CA2
Water SCHEMBL9517059 0.97 ACE (0.59) ACEFOLH1NAALAD2CA1CA2
Water SCHEMBL27998556 0.97 ACE (0.59) ACEFOLH1NAALAD2CA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109694399-A A kind of preparation method of Glycyl-L-tyrosine zinc 张欣 2019-04-30 CN claimed
CN-109694399-A A kind of preparation method of Glycyl-L-tyrosine zinc 张欣 2019-04-30 CN disclosed
CN-109694399-A A kind of preparation method of Glycyl-L-tyrosine zinc 张欣 2019-04-30 CN disclosed
CN-109694399-A A kind of preparation method of Glycyl-L-tyrosine zinc 张欣 2019-04-30 CN disclosed