SCHEMBL28171998

SCHEMBL28171998

O=C(CCl)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 3/20 0.58
ICAM1 P05362 3/20 0.58
ITGAL P20701 3/20 0.58
SLC6A5 Q9Y345 1/20 0.58
SLC15A2 Q16348 1/20 0.56
EPHX2 P34913 1/20 0.55
CA1 P00915 3/20 0.55
CA2 P00918 3/20 0.55
CYP3A4 P08684 3/20 0.54
SLC7A5 Q01650 1/20 0.54
AGTR2 P50052 1/20 0.50
ALDH1A1 P00352 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
HIF1A Q16665 1/20 0.47
GGT1 P19440 1/20 0.47
CPB2 Q96IY4 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
SCHEMBL4182511 0.86 SLC6A5 (0.64) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL11487904 0.86 ITGB2 (0.58) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL30081493 0.86 SLC15A2 (0.72) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL6425165 0.86 ITGB2 (0.58) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL2197786 0.86 SLC15A2 (0.72) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL27413426 0.85 ITGB2 (0.67) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL29002721 0.85 HTR1D (0.48) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL29071832 0.84 SLC6A5 (0.63) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL19051473 0.84 SLC6A5 (0.63) ITGB2ICAM1ITGALSLC6A5SLC15A2
SCHEMBL16364167 0.84 SLC6A5 (0.62) ITGB2ICAM1ITGALSLC6A5SLC15A2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116143867-A Method for preparing GHK tripeptide and blue copper peptide without condensing agent 上海锐康生物技术研发有限公司 2023-05-23 CN disclosed
CN-113150066-B Synthetic method of blue copper peptide 山东济肽生物科技有限公司 2022-04-08 CN disclosed
CN-113150066-B Synthetic method of blue copper peptide 山东济肽生物科技有限公司 2022-04-08 CN disclosed
CN-113150066-A Synthetic method of blue copper peptide 山东济肽生物科技有限公司 2021-07-23 CN disclosed
CN-113150066-A Synthetic method of blue copper peptide 山东济肽生物科技有限公司 2021-07-23 CN disclosed
CN-107098950-B A kind of synthetic method of GHK or AHK tripeptides 湖北泓肽生物科技有限公司 2019-11-08 CN disclosed
CN-107098950-A A kind of synthetic method of GHK or AHK tripeptides 湖北泓肽生物科技有限公司 2017-08-29 CN disclosed