Dopamine

Dopamine

SCHEMBL29599861

Cl.[2H]N([2H])CCc1ccc(O)c(O)c1

nearest known ligand 0.74

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
MAPT P10636 5/20 0.74
KDM4E B2RXH2 4/20 0.74
LMNA P02545 4/20 0.74
MAPK1 P28482 3/20 0.74
ADRA2A P08913 2/20 0.74
DRD2 P14416 2/20 0.74
DRD1 P21728 2/20 0.74
DRD4 P21917 2/20 0.74
DRD5 P21918 2/20 0.74
SLC6A2 P23975 2/20 0.74
DRD3 P35462 2/20 0.74
RECQL P46063 2/20 0.74
SLC6A3 Q01959 2/20 0.74
TDP1 Q9NUW8 2/20 0.74
GAA P10253 2/20 0.74
BLM P54132 2/20 0.74
GFER P55789 2/20 0.74
PMP22 Q01453 2/20 0.74
ALOX15 P16050 5/20 0.70
ALDH1A1 P00352 3/20 0.70

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 SCHEMBL50427 0.98 ALOX15 (0.73) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL29435413 0.98 ALOX15 (0.73) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL29456593 0.86 ALOX15 (0.73) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL50897 0.86 ALOX15 (0.73) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL23704750 0.85 KDM4E (1.00) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL29831984 0.85 KDM4E (1.00) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL3954271 0.85 KDM4E (1.00) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL29636832 0.85 KDM4E (1.00) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL30379446 0.85 KDM4E (1.00) MAPTKDM4ELMNAMAPK1ADRA2A
Dopamine SCHEMBL40952 0.85 KDM4E (1.00) MAPTKDM4ELMNAMAPK1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116173227-A Targeted magnetic nano-composite of palygorskite, preparation method and application thereof in preparation of in-vitro drug controlled release drug 淮阴师范学院 2023-05-30 CN claimed
CN-113881040-B Preparation method and application of two-dimensional MXene/polydopamine composite desalting electrode material 上海交通大学 2022-05-31 CN claimed
CN-116327932-A Preparation method and application of pH response type bionic gold nano-drug for chemotherapy, thermotherapy and targeted therapy 河南大学 2023-06-27 CN disclosed
CN-116173227-A Targeted magnetic nano-composite of palygorskite, preparation method and application thereof in preparation of in-vitro drug controlled release drug 淮阴师范学院 2023-05-30 CN disclosed