SCHEMBL31295726

SCHEMBL31295726

CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 4/20 0.52
▸ GLP1R P43220 2/20 0.50
▸ CCKBR P32239 1/20 0.50
▸ ECE1 P42892 1/20 0.49
▸ MUS81 Q96NY9 1/20 0.49
▸ PTH1R Q03431 1/20 0.49
▸ VIPR1 P32241 1/20 0.49
▸ CALCR P30988 3/20 0.48
▸ NPY2R P49146 3/20 0.47
▸ NPY4R P50391 3/20 0.47
▸ NPY5R Q15761 3/20 0.47
▸ NPY1R P25929 2/20 0.47

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
SCHEMBL30432112 0.89 RXFP1 (0.60) RXFP1GLP1RCCKBRPTH1RVIPR1
SCHEMBL31410830 0.89 GLP1R (0.50) GLP1RECE1MUS81PTH1RVIPR1
SCHEMBL31182628 0.86 RXFP1 (0.54) RXFP1GLP1RECE1MUS81VIPR1
SCHEMBL30607454 0.86 RXFP1 (0.53) RXFP1GLP1RCCKBRPTH1RVIPR1
SCHEMBL31307261 0.86 RXFP1 (0.47) RXFP1GLP1RECE1MUS81PTH1R
SCHEMBL30432137 0.85 PTH1R (0.51) RXFP1GLP1RCCKBRECE1MUS81
SCHEMBL30432507 0.85 BACE1 (0.59) RXFP1GLP1RCCKBRECE1MUS81
SCHEMBL30433492 0.85 PTH1R (0.57) RXFP1GLP1RCCKBRPTH1RVIPR1
SCHEMBL31182832 0.85 RXFP1 (0.61) RXFP1GLP1RCCKBRPTH1RVIPR1
SCHEMBL30608551 0.85 GLP1R (0.59) GLP1RECE1MUS81VIPR1

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-119120488-A Corn internode length regulation gene ZmIL, expression product, excellent haplotype and application thereof in corn breeding 河南农业大学 2024-12-13 — — CN disclosed
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