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Compile Data Set for Download or QSAR

Found 82 hits of ec50 data for polymerid = 1513,49000210,49000214,49000217,49000224,49000226   
Target
(Institution)
LigandTarget
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
Adrenergic receptor alpha


(HUMAN)
BDBM50085683
PNG
((+)-4-((S)-alpha,2,3-trimethylbenzyl)imidazole | 4...)
Show SMILES C[C@H](c1cnc[nH]1)c1cccc(C)c1C
Show InChI InChI=1S/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)/t11-/m0/s1
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n/an/an/an/a 1.5n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM34572
PNG
(BRIMONIDINE | CHEMBL844 | MLS000069370 | SMR000058...)
Show SMILES Brc1c(NC2=NCCN2)ccc2nccnc12
Show InChI InChI=1S/C11H10BrN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)
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n/an/an/an/a 4.10n/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Effective concentration at Alpha-2A adrenergic receptor from CHO-C10 cells


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50019646
PNG
(2-(alpha-(2,6-Dichlorophenoxy)ethyl)2-imidazoline ...)
Show SMILES CC(Oc1c(Cl)cccc1Cl)C1=NCCN1
Show InChI InChI=1S/C11H12Cl2N2O/c1-7(11-14-5-6-15-11)16-10-8(12)3-2-4-9(10)13/h2-4,7H,5-6H2,1H3,(H,14,15)
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n/an/an/an/a 6.30n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor aplha 2A expressed in CHO cells assessed as rate of extracellular acidification by cytosensor microphysiometri...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50016897
PNG
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)
Show SMILES Clc1cccc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
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n/an/an/an/a 8.30n/an/an/an/a



Universita` di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO cells assessed as induction of extracellular acidification by microphysiometry


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50013515
PNG
((+)-yohimbine | (16alpha,17alpha)-17-hydroxyyohimb...)
Show SMILES COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
Show InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1
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n/an/an/an/a 8.5n/an/an/an/a



Tom's of Maine

Curated by ChEMBL


Assay Description
Displacement of [3H]MK912 from human recombinant adrenergic alpha2A receptor expressed in Sf9 cells


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50055832
PNG
((1H-Imidazol-2-yl)-(5-methyl-2,3-dihydro-benzo[1,4...)
Show SMILES Cc1c(Nc2ncc[nH]2)ccc2OCCOc12
Show InChI InChI=1S/C12H13N3O2/c1-8-9(15-12-13-4-5-14-12)2-3-10-11(8)17-7-6-16-10/h2-5H,6-7H2,1H3,(H2,13,14,15)
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n/an/an/an/a 8.70n/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Effective concentration at Alpha-2A adrenergic receptor from CHO-C10 cells


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50419884
PNG
(CHEMBL157955)
Show SMILES CCc1cccc(CC)c1OC(C)C1=NCCN1
Show InChI InChI=1S/C15H22N2O/c1-4-12-7-6-8-13(5-2)14(12)18-11(3)15-16-9-10-17-15/h6-8,11H,4-5,9-10H2,1-3H3,(H,16,17)
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n/an/an/an/a 12n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor aplha 2A expressed in CHO cells assessed as rate of extracellular acidification by cytosensor microphysiometri...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50334196
PNG
(3-[(Imidazolidin-2-yl)imino]-4-methylindazole hydr...)
Show SMILES Cc1cccc2n[nH]c(N=C3NCCN3)c12
Show InChI InChI=1S/C11H13N5/c1-7-3-2-4-8-9(7)10(16-15-8)14-11-12-5-6-13-11/h2-4H,5-6H2,1H3,(H3,12,13,14,15,16)
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n/an/an/an/a 14n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50334201
PNG
(7-Cl-Marsanidine | CHEMBL1641690)
Show SMILES Clc1cccc2cnn(N=C3NCCN3)c12
Show InChI InChI=1S/C10H10ClN5/c11-8-3-1-2-7-6-14-16(9(7)8)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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n/an/an/an/a 15n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50419889
PNG
(CHEMBL155866)
Show SMILES CC(Oc1c(C)cccc1C)C1=NCCN1
Show InChI InChI=1S/C13H18N2O/c1-9-5-4-6-10(2)12(9)16-11(3)13-14-7-8-15-13/h4-6,11H,7-8H2,1-3H3,(H,14,15)
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n/an/an/an/a 19n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor aplha 2A expressed in CHO cells assessed as rate of extracellular acidification by cytosensor microphysiometri...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50377391
PNG
(CHEMBL402388)
Show SMILES COc1cccc2C(CCc12)c1ncc[nH]1
Show InChI InChI=1S/C13H14N2O/c1-16-12-4-2-3-9-10(12)5-6-11(9)13-14-7-8-15-13/h2-4,7-8,11H,5-6H2,1H3,(H,14,15)
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n/an/an/an/a 27n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human cloned adrenergic alpha-2A receptor expressed in CHOK1 cells by beta-lactamase reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50016897
PNG
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)
Show SMILES Clc1cccc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
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n/an/an/an/a 28n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50016897
PNG
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)
Show SMILES Clc1cccc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
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n/an/an/an/a 30n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor alpha2A expressed in CHOK1 cells assessed as stimulation of agonist-induced [35S]GTPgammaS binding by scintill...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50419883
PNG
(CHEMBL1956201)
Show SMILES CC(Oc1ccccc1C=O)C1=NCCN1
Show InChI InChI=1S/C12H14N2O2/c1-9(12-13-6-7-14-12)16-11-5-3-2-4-10(11)8-15/h2-5,8-9H,6-7H2,1H3,(H,13,14)
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n/an/an/an/a 32n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor aplha 2A expressed in CHO cells assessed as rate of extracellular acidification by cytosensor microphysiometri...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50270556
PNG
(1-[(Imidazolidin-2-yl)imino]-7-methylindazole hydr...)
Show SMILES Cc1cccc2cnn(N=C3NCCN3)c12
Show InChI InChI=1S/C11H13N5/c1-8-3-2-4-9-7-14-16(10(8)9)15-11-12-5-6-13-11/h2-4,7H,5-6H2,1H3,(H2,12,13,15)
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n/an/an/an/a 37n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50419888
PNG
(CHEMBL1956202)
Show SMILES CC(Oc1ccccc1C(C)=O)C1=NCCN1
Show InChI InChI=1S/C13H16N2O2/c1-9(16)11-5-3-4-6-12(11)17-10(2)13-14-7-8-15-13/h3-6,10H,7-8H2,1-2H3,(H,14,15)
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n/an/an/an/a 63n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor aplha 2A expressed in CHO cells assessed as rate of extracellular acidification by cytosensor microphysiometri...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50417349
PNG
(CHEMBL1276248)
Show SMILES C[C@H](Oc1ccccc1-c1ccsc1)C1=NCCN1
Show InChI InChI=1S/C15H16N2OS/c1-11(15-16-7-8-17-15)18-14-5-3-2-4-13(14)12-6-9-19-10-12/h2-6,9-11H,7-8H2,1H3,(H,16,17)/t11-/m0/s1
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n/an/an/an/a 63n/an/an/an/a



Universita` di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO cells assessed as induction of extracellular acidification by microphysiometry


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50412244
PNG
(CHEMBL495096)
Show SMILES CC(Oc1ccccc1C1CCCC1)C1=NCCN1
Show InChI InChI=1S/C16H22N2O/c1-12(16-17-10-11-18-16)19-15-9-5-4-8-14(15)13-6-2-3-7-13/h4-5,8-9,12-13H,2-3,6-7,10-11H2,1H3,(H,17,18)
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n/an/an/an/a 63n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant adrenergic alpha2A receptor expressed in CHO cells assessed as stimulation of extracellular acidification


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50334197
PNG
(7-Chloro-3-[(imidazolidin-2-yl)imino]indazole hydr...)
Show SMILES Clc1cccc2c(N=C3NCCN3)[nH]nc12
Show InChI InChI=1S/C10H10ClN5/c11-7-3-1-2-6-8(7)15-16-9(6)14-10-12-4-5-13-10/h1-3H,4-5H2,(H3,12,13,14,15,16)
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n/an/an/an/a 73n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50417354
PNG
(CHEMBL396013)
Show SMILES C[C@H](Oc1ccccc1-c1ccccc1)C1=NCCN1
Show InChI InChI=1S/C17H18N2O/c1-13(17-18-11-12-19-17)20-16-10-6-5-9-15(16)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,18,19)/t13-/m0/s1
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n/an/an/an/a 74n/an/an/an/a



Università degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonistic potency at human adrenergic alpha-2A receptor expressed in CHO cells assessed as forskolin-induced cAMP accumulation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50417354
PNG
(CHEMBL396013)
Show SMILES C[C@H](Oc1ccccc1-c1ccccc1)C1=NCCN1
Show InChI InChI=1S/C17H18N2O/c1-13(17-18-11-12-19-17)20-16-10-6-5-9-15(16)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,18,19)/t13-/m0/s1
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n/an/an/an/a 74n/an/an/an/a



Universita` di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO cells assessed as induction of extracellular acidification by microphysiometry


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50417347
PNG
(CHEMBL385310)
Show SMILES CC(Oc1ccccc1-c1ccsc1)C1=NCCN1
Show InChI InChI=1S/C15H16N2OS/c1-11(15-16-7-8-17-15)18-14-5-3-2-4-13(14)12-6-9-19-10-12/h2-6,9-11H,7-8H2,1H3,(H,16,17)
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n/an/an/an/a 76n/an/an/an/a



Universita` di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO cells assessed as induction of extracellular acidification by microphysiometry


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50412258
PNG
(CHEMBL451229)
Show SMILES CC(Oc1ccccc1C1CCCCC1)C1=NCCN1
Show InChI InChI=1S/C17H24N2O/c1-13(17-18-11-12-19-17)20-16-10-6-5-9-15(16)14-7-3-2-4-8-14/h5-6,9-10,13-14H,2-4,7-8,11-12H2,1H3,(H,18,19)
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n/an/an/an/a 79n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant adrenergic alpha2A receptor expressed in CHO cells assessed as stimulation of extracellular acidification


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50334194
PNG
(3-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)
Show SMILES C1CNC(N1)=Nc1[nH]nc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-2-4-8-7(3-1)9(15-14-8)13-10-11-5-6-12-10/h1-4H,5-6H2,(H3,11,12,13,14,15)
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n/an/an/an/a 82n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50002903
PNG
(CHEMBL223836)
Show SMILES CC(Oc1ccccc1-c1cccc(F)c1)C1=NCCN1
Show InChI InChI=1S/C17H17FN2O/c1-12(17-19-9-10-20-17)21-16-8-3-2-7-15(16)13-5-4-6-14(18)11-13/h2-8,11-12H,9-10H2,1H3,(H,19,20)
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n/an/an/an/a 105n/an/an/an/a



Università degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonistic potency at human adrenergic alpha-2A receptor expressed in CHO cells assessed as forskolin-induced cAMP accumulation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50029051
PNG
((-)-arterenol | (-)-noradrenaline | (-)-norepineph...)
Show SMILES NC[C@H](O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
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n/an/an/an/a 110n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50412250
PNG
(CHEMBL128168)
Show SMILES CC(Oc1ccccc1-c1ccccc1)C1=NCCN1
Show InChI InChI=1S/C17H18N2O/c1-13(17-18-11-12-19-17)20-16-10-6-5-9-15(16)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,18,19)
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n/an/an/an/a 115n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant adrenergic alpha2A receptor expressed in CHO cells assessed as stimulation of extracellular acidification


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50412250
PNG
(CHEMBL128168)
Show SMILES CC(Oc1ccccc1-c1ccccc1)C1=NCCN1
Show InChI InChI=1S/C17H18N2O/c1-13(17-18-11-12-19-17)20-16-10-6-5-9-15(16)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,18,19)
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n/an/an/an/a 115n/an/an/an/a



Università degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonistic potency at human adrenergic alpha-2A receptor expressed in CHO cells assessed as forskolin-induced cAMP accumulation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50412250
PNG
(CHEMBL128168)
Show SMILES CC(Oc1ccccc1-c1ccccc1)C1=NCCN1
Show InChI InChI=1S/C17H18N2O/c1-13(17-18-11-12-19-17)20-16-10-6-5-9-15(16)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,18,19)
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n/an/an/an/a 115n/an/an/an/a



Universita` di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO cells assessed as induction of extracellular acidification by microphysiometry


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50029051
PNG
((-)-arterenol | (-)-noradrenaline | (-)-norepineph...)
Show SMILES NC[C@H](O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
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n/an/an/an/a 118n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor alpha2A expressed in CHOK1 cells assessed as stimulation of agonist-induced [35S]GTPgammaS binding by scintill...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50055830
PNG
((1H-Imidazol-2-yl)-(5-methyl-3,4-dihydro-2H-benzo[...)
Show SMILES Cc1c(Nc2ncc[nH]2)ccc2OCCNc12
Show InChI InChI=1S/C12H14N4O/c1-8-9(16-12-14-4-5-15-12)2-3-10-11(8)13-6-7-17-10/h2-5,13H,6-7H2,1H3,(H2,14,15,16)
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n/an/an/an/a 124n/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Effective concentration at Alpha-2A adrenergic receptor from CHO-C10 cells


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50271255
PNG
(1-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)
Show SMILES C1CNC(N1)=Nn1ncc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-2-4-9-8(3-1)7-13-15(9)14-10-11-5-6-12-10/h1-4,7H,5-6H2,(H2,11,12,14)
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n/an/an/an/a 160n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50271294
PNG
(4-Chloro-1-[(imidazolidin-2-yl)imino]indazole hydr...)
Show SMILES Clc1cccc2n(N=C3NCCN3)ncc12
Show InChI InChI=1S/C10H10ClN5/c11-8-2-1-3-9-7(8)6-14-16(9)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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n/an/an/an/a 180n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50334195
PNG
(4-Chloro-3-[(imidazolidin-2-yl)imino]indazole hydr...)
Show SMILES Clc1cccc2n[nH]c(N=C3NCCN3)c12
Show InChI InChI=1S/C10H10ClN5/c11-6-2-1-3-7-8(6)9(16-15-7)14-10-12-4-5-13-10/h1-3H,4-5H2,(H3,12,13,14,15,16)
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n/an/an/an/a 240n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha2A adrenergic receptor expressed in CHO cells assessed as induction of [35S]GTPgammaS binding after 60 min...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50002905
PNG
(CHEMBL373535)
Show SMILES CC(Oc1ccccc1-c1cccnc1)C1=NCCN1
Show InChI InChI=1S/C16H17N3O/c1-12(16-18-9-10-19-16)20-15-7-3-2-6-14(15)13-5-4-8-17-11-13/h2-8,11-12H,9-10H2,1H3,(H,18,19)
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n/an/an/an/a 316n/an/an/an/a



Università degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonistic potency at human adrenergic alpha-2A receptor expressed in CHO cells assessed as forskolin-induced cAMP accumulation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50377390
PNG
(CHEMBL256984)
Show SMILES COc1c2CCC(c3ncc[nH]3)c2ccc1C
Show InChI InChI=1S/C14H16N2O/c1-9-3-4-10-11(13(9)17-2)5-6-12(10)14-15-7-8-16-14/h3-4,7-8,12H,5-6H2,1-2H3,(H,15,16)
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n/an/an/an/a 327n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human cloned adrenergic alpha-2A receptor expressed in CHOK1 cells by beta-lactamase reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50029051
PNG
((-)-arterenol | (-)-noradrenaline | (-)-norepineph...)
Show SMILES NC[C@H](O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
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n/an/an/an/a 372n/an/an/an/a



Universita degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO cells assessed as extracellular acidification by cytosensor microphysiometry


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50029051
PNG
((-)-arterenol | (-)-noradrenaline | (-)-norepineph...)
Show SMILES NC[C@H](O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
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n/an/an/an/a 372n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant adrenergic alpha2A receptor expressed in CHO cells assessed as stimulation of extracellular acidification


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50029051
PNG
((-)-arterenol | (-)-noradrenaline | (-)-norepineph...)
Show SMILES NC[C@H](O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
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n/an/an/an/a 372n/an/an/an/a



Università degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonistic potency at human adrenergic alpha-2A receptor expressed in CHO cells assessed as forskolin-induced cAMP accumulation


Citation and Details
Checked by Author
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50412249
PNG
(CHEMBL493675)
Show SMILES CC(Oc1ccccc1CN=O)C1=NCCN1
Show InChI InChI=1S/C12H15N3O2/c1-9(12-13-6-7-14-12)17-11-5-3-2-4-10(11)8-15-16/h2-5,9H,6-8H2,1H3,(H,13,14)
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n/an/an/an/a 501n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant adrenergic alpha2A receptor expressed in CHO cells assessed as stimulation of extracellular acidification


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50419882
PNG
(CHEMBL1956200)
Show SMILES CC(Oc1ccccc1S(C)(=O)=O)C1=NCCN1
Show InChI InChI=1S/C12H16N2O3S/c1-9(12-13-7-8-14-12)17-10-5-3-4-6-11(10)18(2,15)16/h3-6,9H,7-8H2,1-2H3,(H,13,14)
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n/an/an/an/a 562n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor aplha 2A expressed in CHO cells assessed as rate of extracellular acidification by cytosensor microphysiometri...


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50377396
PNG
(CHEMBL258007)
Show SMILES C1CC(c2ncc[nH]2)c2ccccc2C1
Show InChI InChI=1S/C13H14N2/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13/h1-2,4,6,8-9,12H,3,5,7H2,(H,14,15)
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n/an/an/an/a 722n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human cloned adrenergic alpha-2A receptor expressed in CHOK1 cells by beta-lactamase reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50412257
PNG
(CHEMBL523048)
Show SMILES C1CN=C(N1)C(Oc1ccccc1-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H20N2O/c1-3-9-17(10-4-1)19-13-7-8-14-20(19)25-21(22-23-15-16-24-22)18-11-5-2-6-12-18/h1-14,21H,15-16H2,(H,23,24)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant adrenergic alpha2A receptor expressed in CHO cells assessed as stimulation of extracellular acidification


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50180256
PNG
(1-((R)-2-aminopropyl)-1H-indazol-6-ol | CHEMBL4373...)
Show SMILES C[C@@H](N)Cn1ncc2ccc(O)cc12
Show InChI InChI=1S/C10H13N3O/c1-7(11)6-13-10-4-9(14)3-2-8(10)5-12-13/h2-5,7,14H,6,11H2,1H3/t7-/m1/s1
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n/an/an/an/a 1.99E+3n/an/an/an/a



Alcon Research, Ltd.

Curated by ChEMBL


Assay Description
Activity at adrenergic alpha2A receptor expressed in human clonic adenocarcinoma HT29 cell by tissue contraction assay


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50180251
PNG
(1-((S)-2-aminopropyl)-1H-indazol-6-ol | CHEMBL3713...)
Show SMILES C[C@H](N)Cn1ncc2ccc(O)cc12
Show InChI InChI=1S/C10H13N3O/c1-7(11)6-13-10-4-9(14)3-2-8(10)5-12-13/h2-5,7,14H,6,11H2,1H3/t7-/m0/s1
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n/an/an/an/a 2.60E+3n/an/an/an/a



Alcon Research, Ltd.

Curated by ChEMBL


Assay Description
Activity at adrenergic alpha2A receptor expressed in human clonic adenocarcinoma HT29 cell by tissue contraction assay


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50417348
PNG
(CHEMBL1276247)
Show SMILES C[C@@H](Oc1ccccc1-c1ccsc1)C1=NCCN1
Show InChI InChI=1S/C15H16N2OS/c1-11(15-16-7-8-17-15)18-14-5-3-2-4-13(14)12-6-9-19-10-12/h2-6,9-11H,7-8H2,1H3,(H,16,17)/t11-/m1/s1
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n/an/an/an/a 3.16E+3n/an/an/an/a



Universita` di Camerino

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO cells assessed as induction of extracellular acidification by microphysiometry


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50377392
PNG
(CHEMBL257976)
Show SMILES CNC(=O)c1cccc2C(CCc12)c1ncc[nH]1
Show InChI InChI=1S/C14H15N3O/c1-15-14(18)12-4-2-3-9-10(12)5-6-11(9)13-16-7-8-17-13/h2-4,7-8,11H,5-6H2,1H3,(H,15,18)(H,16,17)
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n/an/an/an/a 4.34E+3n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human cloned adrenergic alpha-2A receptor expressed in CHOK1 cells by beta-lactamase reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50360000
PNG
(CHEMBL1928316)
Show SMILES C(C1=NCCN1)n1ncc2ccccc12
Show InChI InChI=1S/C11H12N4/c1-2-4-10-9(3-1)7-14-15(10)8-11-12-5-6-13-11/h1-4,7H,5-6,8H2,(H,12,13)
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n/an/an/an/a 4.50E+3n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human adrenoceptor alpha2A expressed in CHOK1 cells assessed as stimulation of agonist-induced [35S]GTPgammaS binding by scintill...


Citation and Details
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Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50377402
PNG
(CHEMBL260576)
Show SMILES C1Cc2c(cccc2-c2cccnc2)C1c1ncc[nH]1
Show InChI InChI=1S/C17H15N3/c1-4-13(12-3-2-8-18-11-12)15-6-7-16(14(15)5-1)17-19-9-10-20-17/h1-5,8-11,16H,6-7H2,(H,19,20)
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n/an/an/an/a 4.58E+3n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human cloned adrenergic alpha-2A receptor expressed in CHOK1 cells by beta-lactamase reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(HUMAN)
BDBM50055835
PNG
((4-tert-Butyl-3-methoxy-2,6-dimethyl-phenyl)-(1H-i...)
Show SMILES COc1c(C)c(Nc2ncc[nH]2)c(C)cc1C(C)(C)C
Show InChI InChI=1S/C16H23N3O/c1-10-9-12(16(3,4)5)14(20-6)11(2)13(10)19-15-17-7-8-18-15/h7-9H,1-6H3,(H2,17,18,19)
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n/an/an/an/a>5.00E+3n/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Effective concentration at Alpha-2A adrenergic receptor from CHO-C10 cells


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Ligand-Target Pair
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