Dopamine

Dopamine

SCHEMBL9166387

NCCc1ccc(O)c(O)c1.NCCc1ccc(O)c(O)c1.NCCc1ccc(O)c(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1

The experimentally established mechanism targets of Dopamine. 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
KDM4E B2RXH2 3/20 1.00
MAPT P10636 3/20 1.00
MAPK1 P28482 3/20 1.00
TAAR1 Q96RJ0 3/20 1.00
ADRA2A P08913 2/20 1.00
DRD2 P14416 2/20 1.00
DRD1 P21728 2/20 1.00
DRD4 P21917 2/20 1.00
DRD5 P21918 2/20 1.00
SLC6A2 P23975 2/20 1.00
DRD3 P35462 2/20 1.00
RECQL P46063 2/20 1.00
SLC6A3 Q01959 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
ALOX15 P16050 2/20 1.00
ALDH1A1 P00352 2/20 1.00
APEX1 P27695 2/20 1.00
TP53 P04637 1/20 1.00
ADRB2 P07550 1/20 1.00
HTR1A P08908 1/20 1.00

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
Dopamine SCHEMBL496657 1.00 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL30379944 1.00 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL8505 1.00 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL29362033 1.00 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL29375089 1.00 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL18159501 1.00 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL16685137 1.00 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL23704750 0.98 KDM4E (1.00) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL1873501 0.98 KDM4E (0.95) KDM4EMAPTMAPK1TAAR1ADRA2A
Dopamine SCHEMBL1668345 0.98 KDM4E (0.95) KDM4EMAPTMAPK1TAAR1ADRA2A

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-2020210642-A1 METHODS AND COMPOSITIONS FOR TREATING UREA CYCLE DISORDERS CAMP4 THERAPEUTICS CORPORATION (US) 2020-10-15 WO disclosed
US-5472983-A Neurodegenerative conditions associated with dopamine depletion, e.g. Alzheimer's, Parkinson's, multiple sclerosis, Huntington's amyltrophic lateral sclerosis and vision defects CENTAUR PHARMACEUTICALS, INC. (US) 1995-12-05 US disclosed