Loperamide

Loperamide

SCHEMBL8409779

CN(C)C(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1.CN(C)C(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1

The experimentally established mechanism targets of Loperamide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 10/20 1.00
DRD4 P21917 5/20 1.00
ADRA2A P08913 3/20 1.00
SLC6A4 P31645 3/20 1.00
DRD2 P14416 3/20 1.00
DRD3 P35462 3/20 1.00
MEN1 O00255 2/20 1.00
LMNA P02545 2/20 1.00
ADRB2 P07550 2/20 1.00
OPRD1 P41143 2/20 1.00
OPRK1 P41145 2/20 1.00
HTR2B P41595 2/20 1.00
SLC6A3 Q01959 2/20 1.00
KMT2A Q03164 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
SIGMAR1 Q99720 2/20 1.00
HRH2 P25021 2/20 1.00
ADRA1A P35348 2/20 1.00
KCNH2 Q12809 2/20 1.00
SCN5A Q14524 2/20 1.00

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
Loperamide SCHEMBL12387663 1.00 OPRM1 (1.00) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL28530 1.00 OPRM1 (1.00) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL8409268 0.99 OPRM1 (1.00) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL21327979 0.99 OPRM1 (1.00) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL15048 0.99 OPRM1 (1.00) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL9068543 0.99 OPRM1 (1.00) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL2346867 0.98 OPRM1 (0.98) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL542589 0.98 OPRM1 (0.96) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL5084617 0.97 OPRM1 (0.94) OPRM1DRD4ADRA2ASLC6A4DRD2
Loperamide SCHEMBL12470757 0.96 OPRM1 (0.92) OPRM1DRD4ADRA2ASLC6A4DRD2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104049059-B A kind of assay method of calcium polycarbophil oligomer SCCPC (CN) 2015-11-18 CN disclosed
CN-104049059-A Determining method of polycarbophil calcium oligomer SUZHOU CHUNGHWA CHEMICAL & PHARMACEUTICAL IND CO LTD 2014-09-17 CN disclosed
US-5980944-A A SOLID ORAL DOSAGE FORM FOR THE TREATMENT OF GASTROINTESTINAL DISTRESS COMPRISING SIMETHICONE AND COATED ACTIVE GRANULES WITH A NONENTERIC POLYMER COATINGS IMPERMEABLE TO SIMETHICONE MCNEIL-PPC, INC. (US) 1999-11-09 US disclosed