SCHEMBL30844404

SCHEMBL30844404

C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 10/20 0.47
▸ KDM1A O60341 2/20 0.44
▸ MAPK8 P45983 1/20 0.44
▸ MAPK9 P45984 1/20 0.44
▸ MAPK10 P53779 1/20 0.44
▸ F2 P00734 1/20 0.43
▸ TACR1 P25103 1/20 0.43
▸ GRB2 P62993 1/20 0.43
▸ APLNR P35414 1/20 0.41

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
SCHEMBL30844293 0.94 REN (0.49) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL29801982 0.92 REN (0.48) RENF2TACR1
SCHEMBL30844402 0.91 REN (0.50) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30844390 0.90 MAPK8 (0.54) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30844396 0.90 ACE (0.46) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL29777729 0.90 REN (0.48) RENF2GRB2
SCHEMBL30844358 0.89 GHSR (0.43) REN
SCHEMBL29801967 0.88 ACE (0.48) RENTACR1
SCHEMBL29801949 0.88 ACE (0.48) RENTACR1
SCHEMBL30284914 0.87 ACE (0.48) REN

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-117858890-A Polypeptide compound and application thereof in treating enteritis 四川好医生攀西药业有限责任公司 2024-04-09 — — CN disclosed
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