Practolol

Practolol

SCHEMBL9117980

CC(=O)Nc1ccc(OCC(O)CNC(C)C)cc1.Cl

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1

The experimentally established mechanism targets of Practolol. 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
ADRB1 known ✓ P08588 4/20 0.97
ADRB2 P07550 5/20 0.97
ADRB3 P13945 3/20 0.97
MEN1 O00255 2/20 0.97
KMT2A Q03164 2/20 0.97
CYP2D6 P10635 2/20 0.97
OPRK1 P41145 1/20 0.97
CYP1A2 P05177 1/20 0.97
ALOX15 P16050 1/20 0.97
TSHR P16473 1/20 0.97
CYP2C19 P33261 1/20 0.97
MAPT P10636 3/20 0.68
LMNA P02545 2/20 0.68
ALDH1A1 P00352 1/20 0.68
HTT P42858 1/20 0.68
PTGS1 P23219 1/20 0.63
SLC6A2 P23975 1/20 0.63
CNR1 P21554 1/20 0.61
ADRA1D P25100 1/20 0.61
ADRA1A P35348 1/20 0.61

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
Practolol SCHEMBL39925 0.99 ADRB2 (1.00) ADRB2ADRB1ADRB3MEN1KMT2A
Practolol SCHEMBL39926 0.99 ADRB2 (1.00) ADRB2ADRB1ADRB3MEN1KMT2A
Practolol SCHEMBL6509191 0.99 ADRB2 (1.00) ADRB2ADRB1ADRB3MEN1KMT2A
SCHEMBL11884649 0.95 ADRB2 (0.92) ADRB2ADRB1ADRB3MEN1KMT2A
Hydrochloric Acid SCHEMBL31148312 0.88 ADRB2 (0.76) ADRB2ADRB1ADRB3MEN1KMT2A
SCHEMBL14307663 0.86 ADRB2 (0.78) ADRB2ADRB1ADRB3MEN1KMT2A
SCHEMBL21793189 0.85 ADRB2 (0.76) ADRB2ADRB1ADRB3MEN1KMT2A
SCHEMBL11640326 0.85 ADRB2 (0.76) ADRB2ADRB1ADRB3MEN1KMT2A
SCHEMBL11078398 0.85 ADRB3 (0.75) ADRB2ADRB1ADRB3MEN1KMT2A
Practolol SCHEMBL11383487 0.84 ADRB2 (0.73) ADRB2ADRB1ADRB3MEN1KMT2A

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
WO-1995020568-A1 PHARMACEUTICAL PRODUCT COMPRISING A SALICYLATE OF AN ESTERIFIABLE BETA-BLOCKER CAL INTERNATIONAL LIMITED (IE) 1995-08-03 WO disclosed
US-4161530-A CYCLIC SUBSTITUTED AMINO ALCOHOL BETA-RECEPTOR-BLOCKING AGENT AND TRYPTOPHANE CIBA-GEIGY CORPORATION (US) 1979-07-17 US disclosed