SCHEMBL30721572

SCHEMBL30721572

C[C@@H](O)[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)C(C)(C)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 7/20 0.61
▸ TFPI P10646 1/20 0.54
▸ IL23R Q5VWK5 1/20 0.52
▸ OPRM1 P35372 3/20 0.52
▸ OPRD1 P41143 3/20 0.52
▸ OPRK1 P41145 3/20 0.52
▸ SCTR P47872 1/20 0.50

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
SCHEMBL30139565 0.92 GLP1R (0.72) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL31347347 0.91 GLP1R (0.51) GLP1ROPRM1OPRD1OPRK1
SCHEMBL30721545 0.91 GLP1R (0.58) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL30721650 0.90 OPRM1 (0.55) TFPIIL23ROPRM1OPRD1OPRK1
SCHEMBL30721551 0.89 GLP1R (0.70) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL31265496 0.86 GLP1R (0.66) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL31347335 0.86 OPRL1 (0.56) TFPIOPRM1OPRD1OPRK1
SCHEMBL30467092 0.86 TFPI (0.62) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL31005075 0.85 TFPI (0.66) GLP1RTFPIIL23R
SCHEMBL30108346 0.85 GLP1R (0.59) GLP1RSCTR

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-117402256-A Protein dimers consisting of GLP-1 and EGF (A) analogues 乐普(北京)医疗器械股份有限公司 2024-01-16 — — CN disclosed
Send feedback