SCHEMBL29805232

SCHEMBL29805232

N=C(N)NCCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ QRFPR Q96P65 5/20 0.60
▸ NPY4R P50391 9/20 0.53
▸ NPY5R Q15761 8/20 0.53
▸ NPY1R P25929 7/20 0.53
▸ NPY2R P49146 5/20 0.53
▸ TFPI P10646 1/20 0.51
▸ OPRM1 P35372 2/20 0.50
▸ OPRD1 P41143 2/20 0.50
▸ OPRK1 P41145 1/20 0.50
▸ IL23R Q5VWK5 1/20 0.49
▸ NMUR2 Q9GZQ4 1/20 0.49
▸ NMUR1 Q9HB89 1/20 0.49

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
SCHEMBL29805279 1.00 QRFPR (0.60) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL29805234 0.97 QRFPR (0.58) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL29794248 0.96 NPY4R (0.56) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL29670860 0.95 QRFPR (0.57) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL29794245 0.94 NPY4R (0.58) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL29670861 0.93 QRFPR (0.54) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL31261768 0.92 NPY4R (0.57) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL30111249 0.91 NPY4R (0.52) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL30481160 0.91 QRFPR (0.64) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL31462118 0.91 QRFPR (0.62) QRFPRNPY4RNPY5RNPY1RNPY2R

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-112661829-B Bioactive peptide GGYGSGGGSGGYGSRRF, and preparation method and application thereof 浙江辉肽生命健康科技有限公司 2022-05-31 — — CN disclosed
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