SCHEMBL29913522

SCHEMBL29913522

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 9/20 0.64
▸ OPRM1 P35372 4/20 0.64
▸ C5AR1 P21730 2/20 0.59
▸ F2 P00734 3/20 0.55

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
SCHEMBL31127566 0.91 OPRM1 (0.60) OPRD1OPRM1C5AR1F2
SCHEMBL29461549 0.89 F2 (0.60) OPRD1OPRM1F2
SCHEMBL31474321 0.88 MC4R (0.58) OPRD1OPRM1C5AR1F2
SCHEMBL32691359 0.87 SLC6A2 (0.70) OPRD1OPRM1C5AR1F2
SCHEMBL29641093 0.87 C5AR1 (0.64) OPRD1OPRM1C5AR1F2
SCHEMBL29641118 0.86 C5AR1 (0.60) OPRD1OPRM1C5AR1F2
SCHEMBL31474272 0.86 MC4R (0.55) OPRD1OPRM1C5AR1F2
SCHEMBL32691552 0.85 SLC6A2 (0.67) OPRD1OPRM1C5AR1F2
SCHEMBL30617831 0.85 F2 (0.58) OPRD1OPRM1C5AR1F2
SCHEMBL29568697 0.85 APLNR (0.54) OPRD1OPRM1C5AR1F2

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-115043905-B Peptide fragment composition for relatively quantitatively analyzing pig glycine guanyltransferase GATM and application thereof 中国农业科学院北京畜牧兽医研究所 2023-10-13 — — CN disclosed
CN-115043905-A Peptide fragment composition for relatively quantitative analysis of porcine glycine amidine transferase GATM and application 中国农业科学院北京畜牧兽医研究所 2022-09-13 — — CN disclosed
Send feedback