Racepinephrine

Racepinephrine

SCHEMBL28243157

CNCC(O)c1ccc(O)c(O)c1.NOc1ccccc1O

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3

The experimentally established mechanism targets of Racepinephrine. 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 9/20 0.68
ADRB1 known ✓ P08588 7/20 0.68
ADRB3 known ✓ P13945 5/20 0.68
ADRA2A known ✓ P08913 3/20 0.68
ADRA2B known ✓ P18089 3/20 0.68
ADRA2C known ✓ P18825 3/20 0.68
ADRA1A known ✓ P35348 3/20 0.68
ADRA1B known ✓ P35368 3/20 0.68
ADRA1D known ✓ P25100 2/20 0.68
KDM4E B2RXH2 7/20 0.68
TDP1 Q9NUW8 6/20 0.68
MAPT P10636 6/20 0.68
HSD17B10 Q99714 6/20 0.68
HIF1A Q16665 6/20 0.68
TSHR P16473 5/20 0.68
DRD3 P35462 5/20 0.68
CYP1A2 P05177 4/20 0.68
DRD2 P14416 4/20 0.68
DRD1 P21728 4/20 0.68
MEN1 O00255 3/20 0.68

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
Epinephrine SCHEMBL6536046 0.87 KDM4E (0.90) ADRB2KDM4EADRB1TDP1MAPT
Racepinephrine SCHEMBL6536048 0.87 KDM4E (0.90) ADRB2KDM4EADRB1TDP1MAPT
SCHEMBL2691392 0.86 KDM4E (0.66) ADRB2KDM4EADRB1TDP1MAPT
Racepinephrine SCHEMBL28025377 0.83 KDM4E (0.93) ADRB2KDM4EADRB1TDP1MAPT
Epinephrine SCHEMBL2691388 0.83 TDP1 (0.93) ADRB2KDM4EADRB1TDP1MAPT
Racepinephrine SCHEMBL3815 0.83 KDM4E (1.00) ADRB2KDM4EADRB1TDP1MAPT
L-Adrenaline SCHEMBL11647 0.83 KDM4E (1.00) ADRB2KDM4EADRB1TDP1MAPT
L-Adrenaline SCHEMBL29519331 0.83 KDM4E (1.00) ADRB2KDM4EADRB1TDP1MAPT
Racepinephrine SCHEMBL11631789 0.83 KDM4E (1.00) ADRB2KDM4EADRB1TDP1MAPT
Racepinephrine SCHEMBL20493843 0.83 KDM4E (1.00) ADRB2KDM4EADRB1TDP1MAPT

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-108472287-A Combination of oxymetazoline and ipratropium for topical nasal application for the treatment of cough 帕博罗·柯德思·博瑞格 2018-08-31 CN disclosed