SCHEMBL29450205

SCHEMBL29450205

CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CXCL8 P10145 10/20 0.62
▸ CXCR4 P61073 2/20 0.56
▸ MC4R P32245 1/20 0.56
▸ MC5R P33032 1/20 0.56
▸ MC3R P41968 1/20 0.56
▸ MC1R Q01726 1/20 0.56
▸ NPY1R P25929 1/20 0.56
▸ NPY2R P49146 1/20 0.56
▸ NPY4R P50391 1/20 0.56
▸ NPY5R Q15761 1/20 0.56
▸ GLP1R P43220 2/20 0.55
▸ GCGR P47871 1/20 0.55
▸ GIPR P48546 1/20 0.55
▸ NTSR2 O95665 1/20 0.54
▸ NTSR1 P30989 1/20 0.54
▸ SORT1 Q99523 1/20 0.54
▸ C5AR1 P21730 1/20 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
SCHEMBL31182795 0.89 CXCL8 (0.63) CXCL8NPY1RNPY2RNPY4RNPY5R
SCHEMBL30600981 0.88 NPY1R (0.60) CXCL8CXCR4NPY1RNPY2RNPY4R
SCHEMBL31182989 0.87 NPY1R (0.67) CXCL8NPY1RNPY2RNPY4RNPY5R
SCHEMBL29440225 0.87 TACR1 (0.59) CXCL8CXCR4NPY1RNPY2RNPY4R
SCHEMBL30310868 0.86 CXCL8 (0.65) CXCL8
SCHEMBL30607355 0.86 CALCR (0.65) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL30392390 0.86 CXCL8 (0.65) CXCL8CXCR4MC4RMC5RMC3R
SCHEMBL29865953 0.85 KISS1R (0.65) CXCL8NPY1RNPY2RNPY4RNPY5R
SCHEMBL31255250 0.85 NTSR2 (0.63) CXCR4NTSR2NTSR1SORT1C5AR1
SCHEMBL31182936 0.85 NPY2R (0.68) CXCL8NPY1RNPY2RNPY4RNPY5R

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-114075264-B Polypeptide for promoting swine organism to generate African swine fever virus antigen specific immune response and application thereof 中国农业科学院兰州兽医研究所 2023-06-16 — — CN disclosed
CN-114075264-A Polypeptide for promoting swine organisms to generate African swine fever virus antigen specific immune response and application thereof 中国农业科学院兰州兽医研究所 2022-02-22 — — CN disclosed
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