SCHEMBL30953205

SCHEMBL30953205

CC(C)[C@H](N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.59
NTSR2 O95665 5/20 0.54
NTSR1 P30989 5/20 0.54
SORT1 Q99523 5/20 0.54
EPHA2 P29317 2/20 0.53
IL23R Q5VWK5 1/20 0.52
NPY2R P49146 5/20 0.51
NPY4R P50391 5/20 0.51
NPY5R Q15761 5/20 0.51
NPY1R P25929 4/20 0.51
C5AR1 P21730 1/20 0.51

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
SCHEMBL30953193 1.00 SLC6A2 (0.59) SLC6A2NTSR2NTSR1SORT1EPHA2
SCHEMBL30953198 0.97 SLC6A2 (0.62) SLC6A2NTSR2NTSR1SORT1EPHA2
SCHEMBL30953197 0.93 SLC6A2 (0.58) SLC6A2NTSR2NTSR1SORT1EPHA2
SCHEMBL30953192 0.93 SLC6A2 (0.58) SLC6A2NTSR2NTSR1SORT1EPHA2
SCHEMBL29457313 0.92 SLC6A2 (0.69) SLC6A2NTSR2NTSR1SORT1EPHA2
SCHEMBL30640883 0.91 NPY2R (0.58) NTSR2NTSR1SORT1EPHA2NPY2R
SCHEMBL30558096 0.90 SLC6A2 (0.60) SLC6A2EPHA2IL23RC5AR1
SCHEMBL30953195 0.89 SLC6A2 (0.61) SLC6A2NTSR2NTSR1SORT1EPHA2
SCHEMBL30943511 0.88 NMUR2 (0.58) NTSR2NTSR1SORT1EPHA2NPY2R
SCHEMBL30906002 0.88 SLC6A2 (0.57) SLC6A2NTSR2NTSR1SORT1EPHA2

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-118178252-A Application of sea cucumber tetrapeptide and its derivatives in cosmetics 上海湃肽生物科技有限公司 2024-06-14 CN disclosed