SCHEMBL30832764

SCHEMBL30832764

NCCCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.43
▸ APLNR P35414 3/20 0.43
▸ GRB2 P62993 1/20 0.43
▸ BDKRB2 P30411 2/20 0.42
▸ TBXA2R P21731 1/20 0.41
▸ AVPR1A P37288 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ OPRD1 P41143 4/20 0.40
▸ OPRM1 P35372 3/20 0.40
▸ ACE P12821 2/20 0.40
▸ NTMT1 Q9BV86 2/20 0.39
▸ NTSR2 O95665 1/20 0.39
▸ NTSR1 P30989 1/20 0.39

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
SCHEMBL31447574 0.89 F2 (0.43) F2APLNRGRB2OPRD1OPRM1
SCHEMBL31447553 0.89 F2 (0.43) F2APLNRGRB2OPRD1OPRM1
SCHEMBL30918801 0.86 APLNR (0.52) F2APLNROPRD1NTSR2NTSR1
SCHEMBL29935747 0.86 ITGB3 (0.45) F2APLNRGRB2TBXA2RAVPR1A
SCHEMBL29935607 0.86 ITGB3 (0.45) F2APLNRGRB2TBXA2RAVPR1A
SCHEMBL30231956 0.86 ITGB3 (0.45) F2APLNRGRB2TBXA2RAVPR1A
SCHEMBL4726314 0.85 APLNR (0.40) F2APLNRGRB2OPRD1OPRM1
SCHEMBL4726312 0.85 APLNR (0.40) F2APLNRGRB2OPRD1OPRM1
SCHEMBL31544467 0.85 APLNR (0.40) F2APLNRGRB2OPRD1OPRM1
SCHEMBL28890650 0.85 APLNR (0.40) F2APLNRGRB2OPRD1OPRM1

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-117720638-A Recombinant IV type humanized collagen with antioxidant and anti-inflammatory activities 西安德诺海思医疗科技有限公司 2024-03-19 — — CN claimed
CN-117720638-A Recombinant IV type humanized collagen with antioxidant and anti-inflammatory activities 西安德诺海思医疗科技有限公司 2024-03-19 — — CN disclosed
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