Epinephrine

Epinephrine

SCHEMBL11236183

CNC[C@H](O)c1ccc(O)c(O)c1.NCCc1ccc(O)c(O)c1.NCCc1ccc(O)c(O)c1

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3

The experimentally established mechanism targets of Epinephrine. 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 8/20 0.72
ADRB1 known ✓ P08588 6/20 0.72
ADRA2A known ✓ P08913 5/20 0.72
ADRB3 known ✓ P13945 5/20 0.72
ADRA1D known ✓ P25100 4/20 0.72
ADRA1A known ✓ P35348 4/20 0.72
ADRA1B known ✓ P35368 4/20 0.72
ADRA2B known ✓ P18089 3/20 0.72
ADRA2C known ✓ P18825 3/20 0.72
MAPT P10636 11/20 0.72
TDP1 Q9NUW8 10/20 0.72
KDM4E B2RXH2 9/20 0.72
HSD17B10 Q99714 7/20 0.72
MAPK1 P28482 7/20 0.72
HIF1A Q16665 5/20 0.72
DRD2 P14416 5/20 0.72
RECQL P46063 5/20 0.72
TSHR P16473 5/20 0.72
MEN1 O00255 4/20 0.72
KMT2A Q03164 4/20 0.72

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
Racepinephrine SCHEMBL11236186 1.00 MAPT (0.72) MAPTTDP1KDM4EADRB2HSD17B10
Racepinephrine SCHEMBL27540379 1.00 MAPT (0.72) MAPTTDP1KDM4EADRB2HSD17B10
Epinephrine SCHEMBL2963939 1.00 MAPT (0.72) MAPTTDP1KDM4EADRB2HSD17B10
Epinephrine SCHEMBL8465140 0.96 TDP1 (0.67) MAPTTDP1KDM4EADRB2HSD17B10
Isoproterenol SCHEMBL10786267 0.86 MAPT (0.74) MAPTTDP1KDM4EADRB2HSD17B10
Epinephrine SCHEMBL2691388 0.85 TDP1 (0.93) MAPTTDP1KDM4EADRB2HSD17B10
L-Adrenaline SCHEMBL11647 0.85 KDM4E (1.00) MAPTTDP1KDM4EADRB2HSD17B10
Racepinephrine SCHEMBL3815 0.85 KDM4E (1.00) MAPTTDP1KDM4EADRB2HSD17B10
Racepinephrine SCHEMBL11631789 0.85 KDM4E (1.00) MAPTTDP1KDM4EADRB2HSD17B10
Racepinephrine SCHEMBL20493843 0.85 KDM4E (1.00) MAPTTDP1KDM4EADRB2HSD17B10

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
US-4342780-A 2-AMINO-2-FLUOROMETHYL-3-(SUBSTITUTED) PHENYL PROPIONIC ACIDS AND DERIVATIVES COADMINISTERED WITH DOPAMINE MERRELL-TORAUDE ET CIE (FR) 1982-08-03 US disclosed