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SCHEMBL29694508

SCHEMBL29694508

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ VIPR2 P41587 10/20 0.66
▸ VIPR1 P32241 9/20 0.64
▸ TFPI P10646 1/20 0.61
▸ GLP1R P43220 2/20 0.55
▸ ECE1 P42892 1/20 0.55
▸ MUS81 Q96NY9 1/20 0.55
▸ GCGR P47871 1/20 0.55
▸ GIPR P48546 1/20 0.55
▸ NPY2R P49146 4/20 0.54
▸ NPY4R P50391 4/20 0.54
▸ NPY5R Q15761 4/20 0.54
▸ NPY1R P25929 3/20 0.54

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
SCHEMBL29694509 0.99 VIPR2 (0.66) VIPR2VIPR1TFPINPY2RNPY4R
SCHEMBL29461568 0.96 VIPR2 (0.65) VIPR2VIPR1TFPIGLP1R
SCHEMBL29694510 0.95 VIPR2 (0.61) VIPR2VIPR1TFPI
SCHEMBL30432804 0.94 VIPR1 (0.70) VIPR2VIPR1TFPIGLP1RECE1
SCHEMBL30176424 0.92 VIPR1 (0.63) VIPR2VIPR1TFPIGLP1RECE1
SCHEMBL30176435 0.91 VIPR1 (0.69) VIPR2VIPR1TFPIGLP1RGCGR
SCHEMBL30929948 0.90 VIPR2 (0.70) VIPR2VIPR1TFPIGLP1RECE1
SCHEMBL30929981 0.90 VIPR2 (0.70) VIPR2VIPR1TFPIGLP1RECE1
SCHEMBL30974522 0.89 VIPR1 (0.61) VIPR2VIPR1TFPINPY2RNPY4R
SCHEMBL30168689 0.89 TFPI (0.57) VIPR2VIPR1TFPI

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-112745382-B Bioactive peptide with amino acid structure LTVINQTQKENLR, and preparation method and application thereof 浙江辉肽生命健康科技有限公司 2022-05-31 — — CN claimed
CN-112745382-B Bioactive peptide with amino acid structure LTVINQTQKENLR, 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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