BindingDB logo
myBDB logout

BDBM50109019 Benzyl-(2-trifluoromethyl-3,6,7,8-tetrahydro-chromeno[7,8-d]imidazol-8-ylmethyl)-amine::CHEMBL313851

SMILES: FC(F)(F)c1nc2ccc3CCC(CNCc4ccccc4)Oc3c2[nH]1

InChI Key: InChIKey=JFFIIIVILGKQSZ-UHFFFAOYSA-N

Data: 5 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50109019   
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


(Rattus norvegicus (rat))
BDBM50109019
PNG
(Benzyl-(2-trifluoromethyl-3,6,7,8-tetrahydro-chrom...)
Show SMILES FC(F)(F)c1nc2ccc3CCC(CNCc4ccccc4)Oc3c2[nH]1
Show InChI InChI=1S/C19H18F3N3O/c20-19(21,22)18-24-15-9-7-13-6-8-14(26-17(13)16(15)25-18)11-23-10-12-4-2-1-3-5-12/h1-5,7,9,14,23H,6,8,10-11H2,(H,24,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
5.80n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research Laboratories

Curated by ChEMBL


Assay Description
Affinity of compound for D2 receptor in rat striatal membrane determined for agonist state (high affinity state, D2 High) [3H]quinpirole as radioliga...


Bioorg Med Chem Lett 12: 271-4 (2002)


BindingDB Entry DOI: 10.7270/Q22J6CDZ
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50109019
PNG
(Benzyl-(2-trifluoromethyl-3,6,7,8-tetrahydro-chrom...)
Show SMILES FC(F)(F)c1nc2ccc3CCC(CNCc4ccccc4)Oc3c2[nH]1
Show InChI InChI=1S/C19H18F3N3O/c20-19(21,22)18-24-15-9-7-13-6-8-14(26-17(13)16(15)25-18)11-23-10-12-4-2-1-3-5-12/h1-5,7,9,14,23H,6,8,10-11H2,(H,24,25)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
37n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research Laboratories

Curated by ChEMBL


Assay Description
Affinity for the Human Dopamine receptor D4 was determined using membranes from CHO cells labeled with [3H]spiperone


Bioorg Med Chem Lett 12: 271-4 (2002)


BindingDB Entry DOI: 10.7270/Q22J6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50109019
PNG
(Benzyl-(2-trifluoromethyl-3,6,7,8-tetrahydro-chrom...)
Show SMILES FC(F)(F)c1nc2ccc3CCC(CNCc4ccccc4)Oc3c2[nH]1
Show InChI InChI=1S/C19H18F3N3O/c20-19(21,22)18-24-15-9-7-13-6-8-14(26-17(13)16(15)25-18)11-23-10-12-4-2-1-3-5-12/h1-5,7,9,14,23H,6,8,10-11H2,(H,24,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
65n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research Laboratories

Curated by ChEMBL


Assay Description
Affinity of compound for Dopamine receptor D2 in rat striatal membrane determined for antagonist state (low affinity state, D2 Low) with [3H]spiperon...


Bioorg Med Chem Lett 12: 271-4 (2002)


BindingDB Entry DOI: 10.7270/Q22J6CDZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50109019
PNG
(Benzyl-(2-trifluoromethyl-3,6,7,8-tetrahydro-chrom...)
Show SMILES FC(F)(F)c1nc2ccc3CCC(CNCc4ccccc4)Oc3c2[nH]1
Show InChI InChI=1S/C19H18F3N3O/c20-19(21,22)18-24-15-9-7-13-6-8-14(26-17(13)16(15)25-18)11-23-10-12-4-2-1-3-5-12/h1-5,7,9,14,23H,6,8,10-11H2,(H,24,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
132n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research Laboratories

Curated by ChEMBL


Assay Description
Affinity for the Dopamine receptor D2S was determined using membranes from CHO cells labeled with [3H]spiperone


Bioorg Med Chem Lett 12: 271-4 (2002)


BindingDB Entry DOI: 10.7270/Q22J6CDZ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50109019
PNG
(Benzyl-(2-trifluoromethyl-3,6,7,8-tetrahydro-chrom...)
Show SMILES FC(F)(F)c1nc2ccc3CCC(CNCc4ccccc4)Oc3c2[nH]1
Show InChI InChI=1S/C19H18F3N3O/c20-19(21,22)18-24-15-9-7-13-6-8-14(26-17(13)16(15)25-18)11-23-10-12-4-2-1-3-5-12/h1-5,7,9,14,23H,6,8,10-11H2,(H,24,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
263n/an/an/an/an/an/an/an/a



Wyeth-Ayerst Research Laboratories

Curated by ChEMBL


Assay Description
Affinity for the Human Dopamine receptor D3 was determined using membranes from CHO cells labeled with [3H]spiperone


Bioorg Med Chem Lett 12: 271-4 (2002)


BindingDB Entry DOI: 10.7270/Q22J6CDZ
More data for this
Ligand-Target Pair