SCHEMBL31318575

SCHEMBL31318575

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

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ VIPR1 P32241 4/20 0.53
▸ VIPR2 P41587 6/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.49
▸ BACE1 P56817 2/20 0.48
▸ TASP1 Q9H6P5 1/20 0.47
▸ ECE1 P42892 1/20 0.47
▸ GLP1R P43220 1/20 0.47
▸ MUS81 Q96NY9 1/20 0.47
▸ GRIN2D O15399 1/20 0.47
▸ GRIN3B O60391 1/20 0.47
▸ GRIN1 Q05586 1/20 0.47
▸ GRIN2A Q12879 1/20 0.47
▸ GRIN2B Q13224 1/20 0.47
▸ GRIN2C Q14957 1/20 0.47
▸ GRIN3A Q8TCU5 1/20 0.47

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
SCHEMBL30122659 0.93 VIPR1 (0.53) VIPR1VIPR2RXFP1BACE1ECE1
SCHEMBL30483990 0.91 VIPR1 (0.55) VIPR1VIPR2RXFP1BACE1ECE1
SCHEMBL30483972 0.90 ENPEP (0.49) VIPR1VIPR2RXFP1BACE1TASP1
SCHEMBL29965025 0.90 VIPR1 (0.56) VIPR1VIPR2RXFP1BACE1ECE1
SCHEMBL29405680 0.89 VIPR1 (0.52) VIPR1VIPR2RXFP1BACE1ECE1
SCHEMBL29489378 0.89 VIPR1 (0.50) VIPR1VIPR2BACE1TASP1GRIN2D
SCHEMBL30912047 0.89 RXFP1 (0.49) VIPR1VIPR2RXFP1BACE1GRIN2D
SCHEMBL30879458 0.89 BACE1 (0.47) VIPR1VIPR2RXFP1BACE1TASP1
SCHEMBL30662325 0.89 VIPR1 (0.58) VIPR1VIPR2RXFP1BACE1GRIN2D
SCHEMBL30912040 0.88 RXFP1 (0.50) VIPR1VIPR2RXFP1BACE1GRIN2D

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-119060320-A Application of injury-responsive polymer nanoparticle loaded polypeptide in treatment of cardiovascular diseases 杭州诺芙泰生物技术有限公司 2024-12-03 — — CN disclosed
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