BDBM50392647 CHEMBL2153559

SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1

InChI Key InChIKey=BPBCIZXGJQIHRC-AWEZNQCLSA-N

Data  4 KI  4 Kd

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50392647   

TargetAlpha-1A adrenergic receptor(Homo sapiens (Human))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKi:  24.0nMAssay Description:Displacement of [3H]prazosin from human cloned alpha1A adrenoceptor expressed in CHO cell membranes after 30 mins by liquid scintillation counterMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 1A(Rattus norvegicus (rat))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKi:  28.8nMAssay Description:Displacement of [3H]-8-OH-DPAT from 5-HT1A receptor in rat hippocampal membranes after 30 mins by liquid scintillation countingMore data for this Ligand-Target Pair
TargetAlpha-1D adrenergic receptor(Homo sapiens (Human))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKi:  79.4nMAssay Description:Displacement of [3H]prazosin from human cloned alpha1D adrenoceptor expressed in CHO cell membranes after 30 mins by liquid scintillation counterMore data for this Ligand-Target Pair
TargetAlpha-1B adrenergic receptor(Homo sapiens (Human))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKi:  447nMAssay Description:Displacement of [3H]prazosin from human cloned alpha1B adrenoceptor expressed in CHO cell membranes after 30 mins by liquid scintillation counterMore data for this Ligand-Target Pair
TargetAlpha-1D adrenergic receptor(Rattus norvegicus (Rat))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKd:  5.75nMAssay Description:Antagonist activity at alpha1D adrenoceptor in Sprague-Dawley rat thoracic aorta assessed as inhibition of noradrenaline-induced contractions after 3...More data for this Ligand-Target Pair
TargetAlpha-1A adrenergic receptor(Rattus norvegicus (Rat))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKd:  39.8nMAssay Description:Antagonist activity at alpha1A adrenoceptor in Sprague-Dawley rat prostate assessed as inhibition of noradrenaline-induced contractions after 30 minsMore data for this Ligand-Target Pair
TargetAlpha-1A adrenergic receptor(Rattus norvegicus (Rat))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKd:  53.7nMAssay Description:Antagonist activity at alpha1A adrenoceptor in Sprague-Dawley rat prostatic vas deferans assessed as inhibition of noradrenaline-induced contractions...More data for this Ligand-Target Pair
TargetAlpha-1B adrenergic receptor(Rattus norvegicus (rat))
Universit£ di Milano

Curated by ChEMBL
LigandPNGBDBM50392647(CHEMBL2153559)
Show SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
Show InChI InChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
Affinity DataKd:  16.6nMAssay Description:Antagonist activity at alpha1B adrenoceptor in Sprague-Dawley rat spleen assessed as inhibition of phenylephrine-induced contractions after 30 minsMore data for this Ligand-Target Pair