Epinephrine

Epinephrine

SCHEMBL660960

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

nearest known ligand 0.96

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 7/20 0.96
ADRB1 known ✓ P08588 6/20 0.93
ADRB3 known ✓ P13945 5/20 0.93
ADRA2A known ✓ P08913 3/20 0.93
ADRA2B known ✓ P18089 3/20 0.93
ADRA2C known ✓ P18825 3/20 0.93
ADRA1A known ✓ P35348 3/20 0.93
ADRA1B known ✓ P35368 3/20 0.93
ADRA1D known ✓ P25100 2/20 0.93
KDM4E B2RXH2 8/20 0.96
BLM P54132 5/20 0.96
PMP22 Q01453 2/20 0.96
NPSR1 Q6W5P4 1/20 0.96
TDP1 Q9NUW8 7/20 0.93
HIF1A Q16665 7/20 0.93
MAPT P10636 6/20 0.93
HSD17B10 Q99714 6/20 0.93
TSHR P16473 5/20 0.93
CYP1A2 P05177 4/20 0.93
MEN1 O00255 3/20 0.93

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 SCHEMBL28308045 0.98 KDM4E (0.96) KDM4EADRB2BLMPMP22NPSR1
Racepinephrine SCHEMBL16667632 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1
Epinephrine SCHEMBL25041 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1
Epinephrine SCHEMBL31267207 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1
Epinephrine SCHEMBL4980185 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1
Epinephrine SCHEMBL4337310 0.98 KDM4E (0.96) KDM4EADRB2BLMPMP22NPSR1
L-Adrenaline SCHEMBL4983607 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1
Racepinephrine SCHEMBL41370 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1
Racepinephrine SCHEMBL31238229 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1
Racepinephrine SCHEMBL9614373 0.98 KDM4E (1.00) KDM4EADRB2BLMPMP22NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2194054-B1 Ligands for G-protein coupled receptors CAMBRIDGE ENTPR LTD (GB) 2014-06-25 EP disclosed
US-8618283-B2 Ligand libraries for screening GPCRs CAMBRIDGE ENTERPRISE LIMITED (GB) 2013-12-31 US disclosed
US-20130172319-A1 Alpha-AminoCycloLactam Ligands for G-Protein Coupled Receptors, and Methods of Using Same Grainger, David J. (GB) 2013-07-04 US disclosed
US-8389279-B2 α-aminocyclolactam ligands for G-protein coupled receptors, and methods of using same CAMBRIDGE ENTERPRISE LIMITED (GB) 2013-03-05 US disclosed
EP-2508515-A1 Ligands for g-protein coupled receptors Cambridge Enterprise Limited (GB) 2012-10-10 EP disclosed
US-20120046198-A1 Ligand Libraries for Screening GPCRs CAMBRIDGE ENTERPRISE LIMITED (GB) 2012-02-23 US disclosed
US-20110288073-A1 Alpha-Aminocyclolactam Ligands for G-protein Coupled Receptors, and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-24 US disclosed
US-8008289-B2 4-(Adamantane-1-carbonylamino)-3-oxo-2-aza-bicyclo[2.2.2]octane; compounds enriched in agonist and antagonists; mediating cellular signalling in response to hormones, neurotransmitters, cytokines CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-08-30 US disclosed
EP-2194054-A1 Ligands for G-protein coupled receptors Cambridge Enterprise Ltd. (GB) 2010-06-09 EP disclosed
EP-1786810-B1 LIGANDS FOR G-PROTEIN COUPLED RECEPTORS CAMBRIDGE ENTPR LTD (GB) 2010-03-17 EP disclosed
US-20080261948-A1 Ligands for G-Protein Coupled Receptors CAMBRIDGE ENTERPRISE LIMITED (GB) 2008-10-23 US disclosed
US-20080161283-A1 4-(Adamantane-1-carbonylamino)-3-oxo-2-aza-bicyclo[2.2.2]octane; compounds enriched in agonist and antagonists; mediating cellular signalling in response to hormones, neurotransmitters, cytokines CAMBRIDGE ENTERPRISE LIMITED (GB) 2008-07-03 US disclosed
EP-1853569-A1 LIGANDS FOR G-PROTEIN COUPLED RECEPTORS Cambridge Enterprise Limited (GB) 2007-11-14 EP disclosed
EP-1786810-A1 LIGANDS FOR G-PROTEIN COUPLED RECEPTORS Cambridge Enterprise Limited (GB) 2007-05-23 EP disclosed
WO-2006085096-A1 LIGANDS FOR G-PROTEIN COUPLED RECEPTORS CAMBRIDGE ENTERPRISE LIMITED (GB) 2006-08-17 WO disclosed
WO-2006024815-A1 LIGANDS FOR G-PROTEIN COUPLED RECEPTORS CAMBRIDGE ENTERPRISE LIMITED (GB) 2006-03-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080261948-A1 Ligands for G-Protein Coupled Receptors GRK5, GPR4, GRK4 ADRB2 57/4885ADRB1 53/4885ADRB3 59/4885
US-20110288073-A1 Alpha-Aminocyclolactam Ligands for G-protein Coupled Receptors, and Methods of Using Same NPY1R, GPR139, GPR18 ADRB2 49/4885ADRB1 11/4885ADRB3 47/4885
US-20130172319-A1 Alpha-AminoCycloLactam Ligands for G-Protein Coupled Receptors, and Methods of Using Same GPR139, ARRB1, GPR84 ADRB2 26/4885ADRB1 6/4885ADRB3 25/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.