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BDBM50290931 3-(1-Propyl-pyrrolidin-3-yl)-phenol::CHEMBL81675

SMILES: CCCN1CCC(C1)c1cccc(O)c1

InChI Key: InChIKey=WPYVGSUSOOZONM-UHFFFAOYSA-N

Data: 5 KI  1 IC50

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 6 hits for monomerid = 50290931   
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(3) dopamine receptor


(Rattus norvegicus (Rat))
BDBM50290931
PNG
(3-(1-Propyl-pyrrolidin-3-yl)-phenol | CHEMBL81675)
Show SMILES CCCN1CCC(C1)c1cccc(O)c1
Show InChI InChI=1S/C13H19NO/c1-2-7-14-8-6-12(10-14)11-4-3-5-13(15)9-11/h3-5,9,12,15H,2,6-8,10H2,1H3
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Article
52n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [3H]-spiperone binding to Dopamine receptor D3 expressed in CHO-K1 cells


Bioorg Med Chem Lett 7: 241-246 (1997)


Article DOI: 10.1016/S0960-894X(96)00618-X
BindingDB Entry DOI: 10.7270/Q200023S
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50290931
PNG
(3-(1-Propyl-pyrrolidin-3-yl)-phenol | CHEMBL81675)
Show SMILES CCCN1CCC(C1)c1cccc(O)c1
Show InChI InChI=1S/C13H19NO/c1-2-7-14-8-6-12(10-14)11-4-3-5-13(15)9-11/h3-5,9,12,15H,2,6-8,10H2,1H3
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52n/an/an/an/an/an/an/an/a



Southern Illinois University Edwardsville

Curated by ChEMBL


Assay Description
Binding affinity to human dopamine D3 receptor


Bioorg Med Chem Lett 28: 1897-1902 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.084
BindingDB Entry DOI: 10.7270/Q2F47RS3
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50290931
PNG
(3-(1-Propyl-pyrrolidin-3-yl)-phenol | CHEMBL81675)
Show SMILES CCCN1CCC(C1)c1cccc(O)c1
Show InChI InChI=1S/C13H19NO/c1-2-7-14-8-6-12(10-14)11-4-3-5-13(15)9-11/h3-5,9,12,15H,2,6-8,10H2,1H3
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Article
68n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [3H]-U-86,170 binding to Dopamine receptor D2 expressed in CHO-K1 cells


Bioorg Med Chem Lett 7: 241-246 (1997)


Article DOI: 10.1016/S0960-894X(96)00618-X
BindingDB Entry DOI: 10.7270/Q200023S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50290931
PNG
(3-(1-Propyl-pyrrolidin-3-yl)-phenol | CHEMBL81675)
Show SMILES CCCN1CCC(C1)c1cccc(O)c1
Show InChI InChI=1S/C13H19NO/c1-2-7-14-8-6-12(10-14)11-4-3-5-13(15)9-11/h3-5,9,12,15H,2,6-8,10H2,1H3
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68n/an/an/an/an/an/an/an/a



Southern Illinois University Edwardsville

Curated by ChEMBL


Assay Description
Binding affinity to human dopamine D2 receptor


Bioorg Med Chem Lett 28: 1897-1902 (2018)


Article DOI: 10.1016/j.bmcl.2018.03.084
BindingDB Entry DOI: 10.7270/Q2F47RS3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50290931
PNG
(3-(1-Propyl-pyrrolidin-3-yl)-phenol | CHEMBL81675)
Show SMILES CCCN1CCC(C1)c1cccc(O)c1
Show InChI InChI=1S/C13H19NO/c1-2-7-14-8-6-12(10-14)11-4-3-5-13(15)9-11/h3-5,9,12,15H,2,6-8,10H2,1H3
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Article
201n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against [3H]-8-OH-DPAT binding to 5-hydroxytryptamine 1A receptor expressed in CHO-K1 cells


Bioorg Med Chem Lett 7: 241-246 (1997)


Article DOI: 10.1016/S0960-894X(96)00618-X
BindingDB Entry DOI: 10.7270/Q200023S
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50290931
PNG
(3-(1-Propyl-pyrrolidin-3-yl)-phenol | CHEMBL81675)
Show SMILES CCCN1CCC(C1)c1cccc(O)c1
Show InChI InChI=1S/C13H19NO/c1-2-7-14-8-6-12(10-14)11-4-3-5-13(15)9-11/h3-5,9,12,15H,2,6-8,10H2,1H3
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UniChem

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Article
n/an/a>1.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]-8-OH-DPAT binding to 5-hydroxytryptamine 1A receptor expressed in CHO-K1 cells


Bioorg Med Chem Lett 7: 241-246 (1997)


Article DOI: 10.1016/S0960-894X(96)00618-X
BindingDB Entry DOI: 10.7270/Q200023S
More data for this
Ligand-Target Pair