SCHEMBL31167363

SCHEMBL31167363

CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 3/20 0.63
▸ RAMP3 O60896 4/20 0.60
▸ CALCR P30988 4/20 0.60
▸ NPY2R P49146 7/20 0.59
▸ NPY4R P50391 7/20 0.59
▸ NPY5R Q15761 7/20 0.59
▸ NPY1R P25929 5/20 0.59
▸ TFPI P10646 2/20 0.57
▸ MAPK8 P45983 1/20 0.57
▸ MAPK9 P45984 1/20 0.57
▸ MAPK10 P53779 1/20 0.57

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
SCHEMBL30176425 0.92 NPY2R (0.64) KEAP1RAMP3CALCRNPY2RNPY4R
SCHEMBL30423064 0.91 KEAP1 (0.69) KEAP1RAMP3CALCRNPY2RNPY4R
SCHEMBL30495594 0.90 NPY2R (0.68) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30432104 0.90 TFPI (0.69) KEAP1NPY2RNPY4RNPY5RNPY1R
SCHEMBL29679794 0.89 CXCR4 (0.61) KEAP1NPY2RNPY4RNPY5RNPY1R
SCHEMBL29827447 0.89 KEAP1 (0.62) KEAP1RAMP3CALCRNPY2RNPY4R
SCHEMBL31461960 0.89 MAPK8 (0.67) KEAP1CALCRNPY2RNPY4RNPY5R
SCHEMBL31034480 0.89 RAMP3 (0.63) KEAP1RAMP3CALCRNPY2RNPY4R
SCHEMBL30432260 0.89 NPY2R (0.61) KEAP1NPY2RNPY4RNPY5RNPY1R
SCHEMBL31474428 0.88 RAMP3 (0.67) KEAP1RAMP3CALCRNPY2RNPY4R

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-118852361-A Duck embryo source antioxidant polypeptide and application thereof 重庆荣戈食品科技有限公司 2024-10-29 — — CN disclosed
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