SCHEMBL30148151

SCHEMBL30148151

NCCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)CN)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 5/20 0.45
▸ OPRM1 P35372 2/20 0.42
▸ NMT1 P30419 5/20 0.41
▸ NMT2 O60551 4/20 0.41
▸ CXCR4 P61073 1/20 0.41
▸ NTSR2 O95665 1/20 0.40
▸ NTSR1 P30989 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ ITGB3 P05106 1/20 0.40
▸ ITGA2B P08514 1/20 0.40
▸ BDKRB2 P30411 1/20 0.39
▸ REN P00797 1/20 0.39

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
SCHEMBL14539432 0.89 ACE (0.47) ACENTSR2NTSR1ITGB3ITGA2B
Goralatide SCHEMBL669284 0.87 ITGB3 (0.49) ACEOPRM1ITGB3ITGA2BREN
SCHEMBL30040838 0.87 ACE (0.49) ACEOPRM1REN
Goralatide SCHEMBL30148825 0.87 ITGB3 (0.49) ACEOPRM1ITGB3ITGA2BREN
Goralatide SCHEMBL25384471 0.87 ITGB3 (0.49) ACEOPRM1ITGB3ITGA2BREN
SCHEMBL23625401 0.86 ACE (0.50) ACEOPRM1REN
SCHEMBL4388468 0.86 ACE (0.50) ACEOPRM1REN
SCHEMBL30434892 0.82 ACE (0.52) ACEOPRM1REN
SCHEMBL12680175 0.82 CXCR4 (0.45) OPRM1CXCR4OPRD1
SCHEMBL2790798 0.82 CXCR4 (0.45) OPRM1CXCR4OPRD1

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
US-20220332763-A1 FUSED POLYPEPTIDE AND USE THEREOF Nanjing Anji Biological Technology Co., Ltd. (CN) 2022-10-20 — — US claimed
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