SCHEMBL29837350

SCHEMBL29837350

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.47
▸ TASP1 Q9H6P5 1/20 0.46
▸ NPY4R P50391 8/20 0.46
▸ NPY1R P25929 6/20 0.46
▸ NPY2R P49146 4/20 0.46
▸ NPY5R Q15761 4/20 0.46
▸ BACE1 P56817 5/20 0.45
▸ VIPR1 P32241 1/20 0.44
▸ BACE2 Q9Y5Z0 1/20 0.44

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
SCHEMBL29837349 0.99 TFPI (0.46) TFPITASP1NPY4RNPY1RNPY2R
SCHEMBL30692435 0.98 TFPI (0.47) TFPITASP1NPY4RNPY1RNPY2R
SCHEMBL30262050 0.94 TFPI (0.50) TFPIBACE1VIPR1BACE2
SCHEMBL29625167 0.92 NPY4R (0.49) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL29696019 0.91 NPY4R (0.49) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL30578960 0.91 BACE1 (0.45) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL31666006 0.90 NPY4R (0.50) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30381394 0.90 TASP1 (0.49) TFPITASP1NPY4RNPY1RNPY2R
SCHEMBL31461989 0.89 TASP1 (0.47) TASP1BACE1VIPR1
SCHEMBL30768183 0.89 BACE1 (0.53) TFPINPY4RNPY1RNPY2RNPY5R

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-115124608-B Barley derived assembling peptide and preparation method and application thereof 上海理工大学 2024-08-27 — — CN claimed
CN-115124608-A Barley-derived self-assembly peptide and preparation method and application thereof 上海理工大学 2022-09-30 — — CN claimed
CN-115124608-B Barley derived assembling peptide and preparation method and application thereof 上海理工大学 2024-08-27 — — CN disclosed
CN-115124608-A Barley-derived self-assembly peptide and preparation method and application thereof 上海理工大学 2022-09-30 — — CN disclosed
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