Isoproterenol

Isoproterenol

SCHEMBL5682030

CC(C)NCC(O)c1ccc(O)c(O)c1.O.O

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ADRB3

The experimentally established mechanism targets of Isoproterenol. 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
ADRB2 known ✓ P07550 7/20 0.97
ADRB1 known ✓ P08588 5/20 0.97
ADRB3 known ✓ P13945 5/20 0.97
MAPT P10636 7/20 0.97
TDP1 Q9NUW8 6/20 0.97
KDM4E B2RXH2 6/20 0.97
TSHR P16473 5/20 0.97
MEN1 O00255 5/20 0.97
KMT2A Q03164 5/20 0.97
MAPK1 P28482 4/20 0.97
HSD17B10 Q99714 4/20 0.97
CYP1A2 P05177 4/20 0.97
HIF1A Q16665 4/20 0.97
MTOR P42345 3/20 0.97
CYP3A4 P08684 3/20 0.97
LMNA P02545 2/20 0.97
NFKB1 P19838 2/20 0.97
ALDH1A1 P00352 2/20 0.97
ADORA3 P0DMS8 2/20 0.97
DRD2 P14416 2/20 0.97

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
Isoproterenol SCHEMBL4165 0.98 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Isoproterenol SCHEMBL3253794 0.98 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Isoproterenol SCHEMBL29519146 0.98 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Isoproterenol SCHEMBL29386243 0.98 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Isoproterenol SCHEMBL4166 0.98 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Levisoprenaline SCHEMBL29620666 0.98 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Levisoprenaline SCHEMBL250806 0.98 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Isoproterenol SCHEMBL1333049 0.97 MAPT (0.97) MAPTADRB2TDP1KDM4EADRB1
Levisoprenaline SCHEMBL4745572 0.97 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1
Isoproterenol SCHEMBL3672791 0.97 MAPT (1.00) MAPTADRB2TDP1KDM4EADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1726008-A2 BIS-PROPYLAMINE ANALOG AND COMPOSITION Verificatin Technologies, Inc (US) 2006-11-29 EP claimed
WO-2005098842-A2 BIS-PROPYLAMINE ANALOG AND COMPOSITION VERIFICATION TECHNOLOGIES, INC. (US) 2005-10-20 WO claimed
CN-107011187-A A kind of preparation method of isoproterenol sulfate dihydrate 山东科源制药股份有限公司 2017-08-04 CN disclosed
EP-1726008-A2 BIS-PROPYLAMINE ANALOG AND COMPOSITION Verificatin Technologies, Inc (US) 2006-11-29 EP disclosed
EP-1709020-A2 PROCESSES FOR PREPARING NOVEL METHYLENE BLUE DERIVATIVE Verification Technologies, Inc (US) 2006-10-11 EP disclosed
EP-1642574-A2 Combination of a beta-2 adrenoceptor agonist and an aminosugar and their use for the treatment of immunomodulatory disorders Astion Development A/S (DK) 2006-04-05 EP disclosed
EP-1496917-B1 COMBINATION OF A BETA-2 ADRENOCEPTOR AGONISTS AND AN AMINOSUGARS AND THEIR USE FOR THE TREATMENT IMMUNOMODULATORY DISORDERS ASTION DEV AS (DK) 2005-12-07 EP disclosed
WO-2005098842-A2 BIS-PROPYLAMINE ANALOG AND COMPOSITION VERIFICATION TECHNOLOGIES, INC. (US) 2005-10-20 WO disclosed
WO-2005049561-A2 PROCESSES FOR PREPARING NOVEL METHYLENE BLUE DERIVATIVE VERIFICATION TECHNOLOGIES, INC. (US) 2005-06-02 WO disclosed