SCHEMBL29453407

SCHEMBL29453407

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CTRB1 P17538 3/20 0.34
▸ ACE P12821 2/20 0.34
▸ PTGS1 P23219 1/20 0.33
▸ GSTK1 Q9Y2Q3 1/20 0.33
▸ GLO1 Q04760 1/20 0.32
▸ MME P08473 2/20 0.32
▸ ECE1 P42892 1/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ OPRD1 P41143 2/20 0.31
▸ OPRM1 P35372 1/20 0.31
▸ OPRK1 P41145 1/20 0.31
▸ CPA1 P15085 1/20 0.31

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
SCHEMBL30988398 0.91 ACE (0.33) ALDH1A1LMNAMAPTPTGS2TDP1
SCHEMBL29590518 0.90 OPRD1 (0.36) PTGS1GSTK1GLO1OPRD1OPRM1
SCHEMBL34464905 0.89 PTGS1 (0.36) ALDH1A1ACEPTGS1GSTK1GLO1
SCHEMBL9373366 0.89 OPRD1 (0.34) PTGS1GSTK1OPRD1OPRM1OPRK1
SCHEMBL29630845 0.88 PTGS1 (0.35) PTGS1GSTK1GLO1OPRD1OPRM1
SCHEMBL30627705 0.88 PTGS1 (0.35) PTGS1GSTK1GLO1OPRD1OPRM1
SCHEMBL31109168 0.87 PTGS1 (0.34) PTGS1GSTK1GLO1OPRD1OPRM1
SCHEMBL31113634 0.86 CTRB1 (0.36) CTRB1ACEMMECPA1ACE2
SCHEMBL749822 0.86 CTRB1 (0.37) CTRB1ACEMMECPA1ACE2
SCHEMBL17293240 0.86 CTRB1 (0.37) CTRB1ACEMMECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114032275-B Pilose antler polypeptide and preparation method thereof 吉林工商学院 2022-09-16 — — CN disclosed
CN-114032275-A Pilose antler polypeptide and preparation method thereof 吉林工商学院 2022-02-11 — — CN disclosed
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