SCHEMBL30400950

SCHEMBL30400950

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nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.53
ACE P12821 2/20 0.52
CPA1 P15085 2/20 0.52
ACE2 Q9BYF1 2/20 0.52
MMP2 P08253 1/20 0.51
MMP7 P09237 1/20 0.51
MMP9 P14780 1/20 0.51
MMP12 P39900 1/20 0.51
MMP13 P45452 1/20 0.51
BACE1 P56817 6/20 0.51
BACE2 Q9Y5Z0 1/20 0.50
NAALAD2 Q9Y3Q0 1/20 0.50

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
SCHEMBL31094623 0.95 MME (0.49) MMEACECPA1ACE2MMP2
SCHEMBL30735528 0.92 MME (0.57) MMEACECPA1ACE2
SCHEMBL31174325 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL1864186 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL233444 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL233445 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL19750987 0.91 BACE1 (0.56) MMEACECPA1ACE2MMP2
SCHEMBL31474490 0.91 MME (0.52) MMEACECPA1ACE2MMP2
SCHEMBL29407166 0.90 ACE (0.54) MMEACECPA1ACE2NAALAD2
SCHEMBL29968694 0.89 BACE1 (0.54) MMEACEBACE1BACE2

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
CN-116179495-A Transgenic immune cells and uses thereof 上海恩凯细胞技术有限公司 2023-05-30 CN disclosed