Tolperisone

Tolperisone

SCHEMBL11664656

CC(=O)NCC(=O)O.Cc1ccc(C(=O)C(C)CN2CCCCC2)cc1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.74
ADRA2B P18089 2/20 0.74
DRD3 P35462 2/20 0.74
SIGMAR1 Q99720 2/20 0.74
HRH3 Q9Y5N1 2/20 0.74
ALDH1A1 P00352 4/20 0.73
LMNA P02545 3/20 0.73
CYP2D6 P10635 1/20 0.57
ADRA2C P18825 1/20 0.57
CHRM3 P20309 1/20 0.57
OPRD1 P41143 1/20 0.57
KCNH2 Q12809 1/20 0.57
SLC6A4 P31645 4/20 0.50
SLC6A3 Q01959 6/20 0.43
SLC6A2 P23975 5/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NTSR1 P30989 1/20 0.42
MITF O75030 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
RAB9A P51151 2/20 0.41

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
SCHEMBL21451092 0.86 CHRM2 (1.00) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL148499 0.86 CHRM2 (1.00) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL4780118 0.86 CHRM2 (1.00) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL17223884 0.86 CHRM2 (1.00) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL4516510 0.86 CHRM2 (1.00) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL872770 0.85 ALDH1A1 (1.00) CHRM2ADRA2BDRD3SIGMAR1HRH3
SCHEMBL9172663 0.85 CHRM2 (0.97) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL15663055 0.84 CHRM2 (0.94) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL4512790 0.80 CHRM2 (0.76) CHRM2ADRA2BDRD3SIGMAR1HRH3
Tolperisone SCHEMBL4513224 0.79 CHRM2 (0.74) CHRM2ADRA2BDRD3SIGMAR1HRH3

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
JP-53040779-A None JP disclosed
JP-S5340779-A OPTICALLY ACTIVE TOLPERTISONE, THEIR PREPARATION AND PHARMACEUTICALS CONTAINTING THE SAME NIPPON KAYAKU CO LTD 1978-04-13 JP disclosed