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2 similar compounds to monomer 50020680

Compile data set for download or QSAR
Wt: 245.3
BDBM50059802
Wt: 259.3
BDBM50059807

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50059802,50059807   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50059802
PNG
(CHEMBL3394274)
Show SMILES O=C1Cc2c(N1)cccc2CCN1CCNCC1
Show InChI InChI=1S/C14H19N3O/c18-14-10-12-11(2-1-3-13(12)16-14)4-7-17-8-5-15-6-9-17/h1-3,15H,4-10H2,(H,16,18)
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a<1.00E+5n/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Agonist activity at human dopamine D2L receptor expressed in CHO cell membranes incubated for 1 hr by [35S]GTPgammaS binding assay


J Med Chem 58: 718-38 (2015)


Article DOI: 10.1021/jm501254d
BindingDB Entry DOI: 10.7270/Q2N87CGR
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50059807
PNG
(CHEMBL3394270)
Show SMILES NC1CCN(CCc2cccc3NC(=O)Cc23)CC1
Show InChI InChI=1S/C15H21N3O/c16-12-5-8-18(9-6-12)7-4-11-2-1-3-14-13(11)10-15(19)17-14/h1-3,12H,4-10,16H2,(H,17,19)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Agonist activity at human dopamine D2L receptor expressed in CHO cell membranes incubated for 1 hr by [35S]GTPgammaS binding assay


J Med Chem 58: 718-38 (2015)


Article DOI: 10.1021/jm501254d
BindingDB Entry DOI: 10.7270/Q2N87CGR
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50059802
PNG
(CHEMBL3394274)
Show SMILES O=C1Cc2c(N1)cccc2CCN1CCNCC1
Show InChI InChI=1S/C14H19N3O/c18-14-10-12-11(2-1-3-13(12)16-14)4-7-17-8-5-15-6-9-17/h1-3,15H,4-10H2,(H,16,18)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Agonist activity at human dopamine D2L receptor expressed in CHO cell membranes incubated for 1 hr by [35S]GTPgammaS binding assay


J Med Chem 58: 718-38 (2015)


Article DOI: 10.1021/jm501254d
BindingDB Entry DOI: 10.7270/Q2N87CGR
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50059807
PNG
(CHEMBL3394270)
Show SMILES NC1CCN(CCc2cccc3NC(=O)Cc23)CC1
Show InChI InChI=1S/C15H21N3O/c16-12-5-8-18(9-6-12)7-4-11-2-1-3-14-13(11)10-15(19)17-14/h1-3,12H,4-10,16H2,(H,17,19)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a<1.00E+5n/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Agonist activity at human dopamine D2L receptor expressed in CHO cell membranes incubated for 1 hr by [35S]GTPgammaS binding assay


J Med Chem 58: 718-38 (2015)


Article DOI: 10.1021/jm501254d
BindingDB Entry DOI: 10.7270/Q2N87CGR
More data for this
Ligand-Target Pair