SCHEMBL29518445

SCHEMBL29518445

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.53
▸ MAPK8 P45983 1/20 0.52
▸ MAPK9 P45984 1/20 0.52
▸ MAPK10 P53779 1/20 0.52
▸ REN P00797 1/20 0.51
▸ OPRM1 P35372 3/20 0.49
▸ OPRD1 P41143 3/20 0.49
▸ OPRK1 P41145 1/20 0.49
▸ KISS1R Q969F8 5/20 0.48
▸ NTSR1 P30989 2/20 0.48
▸ NTSR2 O95665 1/20 0.47
▸ CALCRL Q16602 1/20 0.47
▸ F2 P00734 1/20 0.46

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
SCHEMBL29742976 0.88 MAPK8 (0.63) KEAP1MAPK8MAPK9MAPK10
SCHEMBL31104091 0.83 REN (0.58) RENNTSR1NTSR2
SCHEMBL31514352 0.83 BECN1 (0.56) KEAP1MAPK8MAPK9MAPK10F2
SCHEMBL30733440 0.83 REN (0.64) KEAP1MAPK8MAPK9MAPK10REN
SCHEMBL30726561 0.82 KEAP1 (0.68) KEAP1MAPK8MAPK9MAPK10REN
SCHEMBL30906522 0.82 MAPK8 (0.67) KEAP1MAPK8MAPK9MAPK10
SCHEMBL30974232 0.82 REN (0.45) RENOPRM1OPRD1NTSR1
SCHEMBL30906421 0.81 KEAP1 (0.68) KEAP1MAPK8MAPK9MAPK10
SCHEMBL30692048 0.81 OPRM1 (0.56) OPRM1OPRD1OPRK1KISS1R
SCHEMBL30123020 0.81 CALCRL (0.49) RENOPRD1KISS1RNTSR2CALCRL

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-114213544-B Anisotropic antibody blocker HBR-7 and preparation method thereof 江苏帆博生物制品有限公司 2023-05-23 — — CN disclosed
CN-114213544-A Heterophilic antibody blocking agent HBR-7 and preparation method thereof 江苏帆博生物制品有限公司 2022-03-22 — — CN disclosed
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