SCHEMBL29614466

SCHEMBL29614466

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 16/20 0.54
▸ C5AR1 P21730 1/20 0.51
▸ TFPI P10646 1/20 0.51
▸ F2 P00734 1/20 0.51
▸ IL23R Q5VWK5 1/20 0.50
▸ 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
SCHEMBL29614508 1.00 GLP1R (0.54) GLP1RC5AR1TFPIF2IL23R
SCHEMBL29614470 0.97 GLP1R (0.52) GLP1RC5AR1TFPIIL23RSCTR
SCHEMBL29614372 0.96 GLP1R (0.53) GLP1RC5AR1TFPIF2IL23R
SCHEMBL31419673 0.88 GLP1R (0.63) GLP1R
SCHEMBL30714768 0.88 GLP1R (0.58) GLP1RSCTR
SCHEMBL31182620 0.87 GLP1R (0.64) GLP1RSCTR
SCHEMBL29649231 0.87 GLP1R (0.62) GLP1RTFPISCTR
SCHEMBL30432888 0.87 GLP1R (0.62) GLP1R
SCHEMBL29502186 0.86 NPY4R (0.52) TFPI
SCHEMBL29716050 0.86 GLP1R (0.62) GLP1RC5AR1TFPISCTR

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-109134659-B Nucleic acid vector and application thereof 中国人民解放军军事医学科学院毒物药物研究所 2022-04-26 — — CN disclosed
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