BindingDB logo
myBDB logout

PubMed code 28493701

Compile data set for download or QSAR
Found 70 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Anoctamin-1


(Homo sapiens (Human))		BDBM50239459
PNG
(CHEMBL4074929)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Br)sc2CCCCCc12
Show InChI InChI=1S/C19H19BrF2N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 30n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]norepinephrine uptake in rat brain synaptosomes

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239465
PNG
(CHEMBL4080525 | US11274074, Control [Ani9])
Show SMILES COc1ccccc1\C=N\NC(=O)COc1ccc(Cl)cc1C
Show InChI InChI=1S/C17H17ClN2O3/c1-12-9-14(18)7-8-15(12)23-11-17(21)20-19-10-13-5-3-4-6-16(13)22-2/h3-10H,11H2,1-2H3,(H,20,21)/b19-10+
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 77n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 20 mins followed by ...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239467
PNG
(CHEMBL4086165)
Show SMILES COc1cc(Nc2ccc(cc2C(O)=O)[N+]([O-])=O)cc2ccccc12
Show InChI InChI=1S/C18H14N2O5/c1-25-17-9-12(8-11-4-2-3-5-14(11)17)19-16-7-6-13(20(23)24)10-15(16)18(21)22/h2-10,19H,1H3,(H,21,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 80n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of TMEM16A (unknown origin) expressed in Xenopus laevis oocytes at -60 mV holding potential by voltage-clamp assay

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239459
PNG
(CHEMBL4074929)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Br)sc2CCCCCc12
Show InChI InChI=1S/C19H19BrF2N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 83n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239465
PNG
(CHEMBL4080525 | US11274074, Control [Ani9])
Show SMILES COc1ccccc1\C=N\NC(=O)COc1ccc(Cl)cc1C
Show InChI InChI=1S/C17H17ClN2O3/c1-12-9-14(18)7-8-15(12)23-11-17(21)20-19-10-13-5-3-4-6-16(13)22-2/h3-10H,11H2,1-2H3,(H,20,21)/b19-10+
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 110n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239433
PNG
(CHEMBL3134585)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C18H17F3N2O2S/c19-18(20,21)17(25)23-16-14(12-9-5-2-6-10-13(12)26-16)15(24)22-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 130n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239428
PNG
(CHEMBL4104024)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)I)sc3CCCCCc23)cc1
Show InChI InChI=1S/C18H16F3IN2O2S/c19-10-6-8-11(9-7-10)23-15(25)14-12-4-2-1-3-5-13(12)27-16(14)24-17(26)18(20,21)22/h6-9H,1-5H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 150n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239446
PNG
(CHEMBL4069503)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCCc12
Show InChI InChI=1S/C18H17F3N2O2S/c1-10-6-2-4-8-12(10)22-15(24)14-11-7-3-5-9-13(11)26-16(14)23-17(25)18(19,20)21/h2,4,6,8H,3,5,7,9H2,1H3,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 170n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239457
PNG
(CHEMBL4071143)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Cl)sc2CCCCCc12
Show InChI InChI=1S/C19H19ClF2N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 180n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239447
PNG
(CHEMBL4090522)
Show SMILES Cc1ccc(NC(=O)c2c(NC(=O)C(F)(F)F)sc3CCCCc23)cc1
Show InChI InChI=1S/C18H17F3N2O2S/c1-10-6-8-11(9-7-10)22-15(24)14-12-4-2-3-5-13(12)26-16(14)23-17(25)18(19,20)21/h6-9H,2-5H2,1H3,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 220n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239470
PNG
(CHEMBL4095338)
Show SMILES FC(F)(I)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C18H17F2IN2O2S/c19-18(20,21)17(25)23-16-14(12-9-5-2-6-10-13(12)26-16)15(24)22-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 230n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239461
PNG
(CHEMBL4074900)
Show SMILES FC(F)(Br)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C18H17BrF2N2O2S/c19-18(20,21)17(25)23-16-14(12-9-5-2-6-10-13(12)26-16)15(24)22-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 230n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239457
PNG
(CHEMBL4071143)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Cl)sc2CCCCCc12
Show InChI InChI=1S/C19H19ClF2N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 230n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239426
PNG
(CHEMBL1444023)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C19H19F3N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 260n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239433
PNG
(CHEMBL3134585)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C18H17F3N2O2S/c19-18(20,21)17(25)23-16-14(12-9-5-2-6-10-13(12)26-16)15(24)22-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 300n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239438
PNG
(CHEMBL4099581)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)F)sc3CCCCCc23)cc1
Show InChI InChI=1S/C18H16F4N2O2S/c19-10-6-8-11(9-7-10)23-15(25)14-12-4-2-1-3-5-13(12)27-16(14)24-17(26)18(20,21)22/h6-9H,1-5H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 320n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of [3H]spiperone binding to Dopamine receptor D2 from rat striatal membranes

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239475
PNG
(CHEMBL4082703)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C17H15F3N2O2S/c18-17(19,20)16(24)22-15-13(11-8-4-5-9-12(11)25-15)14(23)21-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,21,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 370n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239469
PNG
(CHEMBL4091961)
Show SMILES FC(F)(F)Oc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCc12
Show InChI InChI=1S/C17H12F6N2O3S/c18-16(19,20)15(27)25-14-12(8-4-3-7-11(8)29-14)13(26)24-9-5-1-2-6-10(9)28-17(21,22)23/h1-2,5-6H,3-4,7H2,(H,24,26)(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 370n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239458
PNG
(CHEMBL4095365)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C21H19F7N2O2S/c1-11-7-5-6-9-13(11)29-16(31)15-12-8-3-2-4-10-14(12)33-17(15)30-18(32)19(22,23)20(24,25)21(26,27)28/h5-7,9H,2-4,8,10H2,1H3,(H,29,31)(H,30,32)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 380n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239459
PNG
(CHEMBL4074929)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Br)sc2CCCCCc12
Show InChI InChI=1S/C19H19BrF2N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 400n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]5-HT transporter uptake in rat brain synaptosomes

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239457
PNG
(CHEMBL4071143)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Cl)sc2CCCCCc12
Show InChI InChI=1S/C19H19ClF2N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 400n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16B expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239426
PNG
(CHEMBL1444023)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C19H19F3N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 420n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239463
PNG
(CHEMBL4087641)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)Br)sc3CCCCCc23)cc1
Show InChI InChI=1S/C18H16BrF3N2O2S/c19-18(21,22)17(26)24-16-14(12-4-2-1-3-5-13(12)27-16)15(25)23-11-8-6-10(20)7-9-11/h6-9H,1-5H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 450n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]dopamine uptake in rat brain synaptosomes

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239448
PNG
(CHEMBL4080209)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)F)sc3CCCCc23)cc1
Show InChI InChI=1S/C17H14F4N2O2S/c18-9-5-7-10(8-6-9)22-14(24)13-11-3-1-2-4-12(11)26-15(13)23-16(25)17(19,20)21/h5-8H,1-4H2,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 490n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239428
PNG
(CHEMBL4104024)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)I)sc3CCCCCc23)cc1
Show InChI InChI=1S/C18H16F3IN2O2S/c19-10-6-8-11(9-7-10)23-15(25)14-12-4-2-1-3-5-13(12)27-16(14)24-17(26)18(20,21)22/h6-9H,1-5H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 600n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239464
PNG
(CHEMBL4085154)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)I)sc2CCCCCc12
Show InChI InChI=1S/C19H19F2IN2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 600n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239439
PNG
(CHEMBL4083154)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1Cl
Show InChI InChI=1S/C18H16ClF3N2O2S/c19-11-7-4-5-8-12(11)23-15(25)14-10-6-2-1-3-9-13(10)27-16(14)24-17(26)18(20,21)22/h4-5,7-8H,1-3,6,9H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 660n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239430
PNG
(CHEMBL4096263)
Show SMILES FC(F)(F)Oc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Br)sc2CCCc12
Show InChI InChI=1S/C17H12BrF5N2O3S/c18-16(19,20)15(27)25-14-12(8-4-3-7-11(8)29-14)13(26)24-9-5-1-2-6-10(9)28-17(21,22)23/h1-2,5-6H,3-4,7H2,(H,24,26)(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 700n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239464
PNG
(CHEMBL4085154)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)I)sc2CCCCCc12
Show InChI InChI=1S/C19H19F2IN2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 730n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239462
PNG
(CHEMBL4066286)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)Cl)sc3CCCCCc23)cc1
Show InChI InChI=1S/C18H16ClF3N2O2S/c19-18(21,22)17(26)24-16-14(12-4-2-1-3-5-13(12)27-16)15(25)23-11-8-6-10(20)7-9-11/h6-9H,1-5H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 840n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239460
PNG
(CHEMBL4103095)
Show SMILES FC(F)(Cl)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C18H17ClF2N2O2S/c19-18(20,21)17(25)23-16-14(12-9-5-2-6-10-13(12)26-16)15(24)22-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,22,24)(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 925n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239466
PNG
(CHEMBL1299863)
Show SMILES CCc1c(C)nc(SCC(=O)Nc2nc(cs2)-c2ccc(OC)cc2)nc1O
Show InChI InChI=1S/C19H20N4O3S2/c1-4-14-11(2)20-18(23-17(14)25)28-10-16(24)22-19-21-15(9-27-19)12-5-7-13(26-3)8-6-12/h5-9H,4,10H2,1-3H3,(H,20,23,25)(H,21,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239428
PNG
(CHEMBL4104024)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)I)sc3CCCCCc23)cc1
Show InChI InChI=1S/C18H16F3IN2O2S/c19-10-6-8-11(9-7-10)23-15(25)14-12-4-2-1-3-5-13(12)27-16(14)24-17(26)18(20,21)22/h6-9H,1-5H2,(H,23,25)(H,24,26)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16B expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239436
PNG
(CHEMBL4087045)
Show SMILES CCC(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C19H22N2O2S/c1-2-16(22)21-19-17(14-11-7-4-8-12-15(14)24-19)18(23)20-13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3,(H,20,23)(H,21,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239437
PNG
(CHEMBL4104905)
Show SMILES CCc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C20H21F3N2O2S/c1-2-12-8-6-7-10-14(12)24-17(26)16-13-9-4-3-5-11-15(13)28-18(16)25-19(27)20(21,22)23/h6-8,10H,2-5,9,11H2,1H3,(H,24,26)(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239456
PNG
(CHEMBL4081693)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCc2c1C(=O)Nc1ccccc1Cl
Show InChI InChI=1S/C16H12ClF3N2O2S/c17-9-5-1-2-6-10(9)21-13(23)12-8-4-3-7-11(8)25-14(12)22-15(24)16(18,19)20/h1-2,5-6H,3-4,7H2,(H,21,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239478
PNG
(CHEMBL4090401)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C20H19F5N2O2S/c1-11-7-5-6-9-13(11)26-16(28)15-12-8-3-2-4-10-14(12)30-17(15)27-18(29)19(21,22)20(23,24)25/h5-7,9H,2-4,8,10H2,1H3,(H,26,28)(H,27,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239472
PNG
(CHEMBL4072679)
Show SMILES Fc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C18H16F4N2O2S/c19-11-7-4-5-8-12(11)23-15(25)14-10-6-2-1-3-9-13(10)27-16(14)24-17(26)18(20,21)22/h4-5,7-8H,1-3,6,9H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239443
PNG
(CHEMBL4091843)
Show SMILES FC(F)(F)Oc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C19H16F6N2O3S/c20-18(21,22)17(29)27-16-14(10-6-2-1-3-9-13(10)31-16)15(28)26-11-7-4-5-8-12(11)30-19(23,24)25/h4-5,7-8H,1-3,6,9H2,(H,26,28)(H,27,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239450
PNG
(CHEMBL4059811)
Show SMILES FC(F)(F)C(=O)Nc1sc2COCCc2c1C(=O)Nc1ccccc1Cl
Show InChI InChI=1S/C16H12ClF3N2O3S/c17-9-3-1-2-4-10(9)21-13(23)12-8-5-6-25-7-11(8)26-14(12)22-15(24)16(18,19)20/h1-4H,5-7H2,(H,21,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239426
PNG
(CHEMBL1444023)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C19H19F3N2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.40E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16B expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239464
PNG
(CHEMBL4085154)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)I)sc2CCCCCc12
Show InChI InChI=1S/C19H19F2IN2O2S/c1-11-7-5-6-9-13(11)23-16(25)15-12-8-3-2-4-10-14(12)27-17(15)24-18(26)19(20,21)22/h5-7,9H,2-4,8,10H2,1H3,(H,23,25)(H,24,26)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.40E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16B expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239467
PNG
(CHEMBL4086165)
Show SMILES COc1cc(Nc2ccc(cc2C(O)=O)[N+]([O-])=O)cc2ccccc12
Show InChI InChI=1S/C18H14N2O5/c1-25-17-9-12(8-11-4-2-3-5-14(11)17)19-16-7-6-13(20(23)24)10-15(16)18(21)22/h2-10,19H,1H3,(H,21,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells assessed as reduction of ATP-induced in chloride conductance preincubated for 5 mins followed by A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239476
PNG
(CHEMBL4098234)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)C(F)(F)F)sc2COCCc12
Show InChI InChI=1S/C18H15F5N2O3S/c1-9-4-2-3-5-11(9)24-14(26)13-10-6-7-28-8-12(10)29-15(13)25-16(27)17(19,20)18(21,22)23/h2-5H,6-8H2,1H3,(H,24,26)(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239431
PNG
(CHEMBL4069000)
Show SMILES FC(F)(F)Oc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)I)sc2CCCc12
Show InChI InChI=1S/C17H12F5IN2O3S/c18-16(19,23)15(27)25-14-12(8-4-3-7-11(8)29-14)13(26)24-9-5-1-2-6-10(9)28-17(20,21)22/h1-2,5-6H,3-4,7H2,(H,24,26)(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.88E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239432
PNG
(CHEMBL4104747)
Show SMILES CC(C)(C)C1CCc2c(C1)sc(NC(=O)c1ccco1)c2C(O)=O
Show InChI InChI=1S/C18H21NO4S/c1-18(2,3)10-6-7-11-13(9-10)24-16(14(11)17(21)22)19-15(20)12-5-4-8-23-12/h4-5,8,10H,6-7,9H2,1-3H3,(H,19,20)(H,21,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.10E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239455
PNG
(CHEMBL4099708)
Show SMILES Cc1ccc(NC(=O)c2c(NC(=O)C(F)(F)F)sc3CCCc23)cc1
Show InChI InChI=1S/C17H15F3N2O2S/c1-9-5-7-10(8-6-9)21-14(23)13-11-3-2-4-12(11)25-15(13)22-16(24)17(18,19)20/h5-8H,2-4H2,1H3,(H,21,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239435
PNG
(CHEMBL4059668)
Show SMILES FC(F)(F)C(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C19H17F5N2O2S/c20-18(21,19(22,23)24)17(28)26-16-14(12-9-5-2-6-10-13(12)29-16)15(27)25-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,25,27)(H,26,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239474
PNG
(CHEMBL4060277)
Show SMILES FC(F)(F)Oc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)C(F)(F)F)sc2CCCCCc12
Show InChI InChI=1S/C20H16F8N2O3S/c21-18(22,19(23,24)25)17(32)30-16-14(10-6-2-1-3-9-13(10)34-16)15(31)29-11-7-4-5-8-12(11)33-20(26,27)28/h4-5,7-8H,1-3,6,9H2,(H,29,31)(H,30,32)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 2.70E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239441
PNG
(CHEMBL3134586)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C18H16ClF3N2O2S/c19-10-6-8-11(9-7-10)23-15(25)14-12-4-2-1-3-5-13(12)27-16(14)24-17(26)18(20,21)22/h6-9H,1-5H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239449
PNG
(CHEMBL4088086)
Show SMILES CCC(=O)Nc1sc2COCCc2c1C(=O)Nc1ccccc1C
Show InChI InChI=1S/C18H20N2O3S/c1-3-15(21)20-18-16(12-8-9-23-10-14(12)24-18)17(22)19-13-7-5-4-6-11(13)2/h4-7H,3,8-10H2,1-2H3,(H,19,22)(H,20,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239477
PNG
(CHEMBL4093932)
Show SMILES Fc1ccc(NC(=O)c2c(NC(=O)C(F)(F)F)sc3COCCc23)cc1
Show InChI InChI=1S/C16H12F4N2O3S/c17-8-1-3-9(4-2-8)21-13(23)12-10-5-6-25-7-11(10)26-14(12)22-15(24)16(18,19)20/h1-4H,5-7H2,(H,21,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239466
PNG
(CHEMBL1299863)
Show SMILES CCc1c(C)nc(SCC(=O)Nc2nc(cs2)-c2ccc(OC)cc2)nc1O
Show InChI InChI=1S/C19H20N4O3S2/c1-4-14-11(2)20-18(23-17(14)25)28-10-16(24)22-19-21-15(9-27-19)12-5-7-13(26-3)8-6-12/h5-9H,4,10H2,1-3H3,(H,20,23,25)(H,21,22,24)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of TMEM16B (unknown origin) expressed in FRT cells assessed as reduction of ATP-induced chloride conductance preincubated for 20 mins foll...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239433
PNG
(CHEMBL3134585)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C18H17F3N2O2S/c19-18(20,21)17(25)23-16-14(12-9-5-2-6-10-13(12)26-16)15(24)22-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,22,24)(H,23,25)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.60E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16B expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239442
PNG
(CHEMBL3134587)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C19H16F6N2O2S/c20-18(21,22)10-6-8-11(9-7-10)26-15(28)14-12-4-2-1-3-5-13(12)30-16(14)27-17(29)19(23,24)25/h6-9H,1-5H2,(H,26,28)(H,27,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239451
PNG
(CHEMBL4073258)
Show SMILES Cc1ccc(NC(=O)c2c(NC(=O)C(F)(F)F)sc3COCCc23)cc1
Show InChI InChI=1S/C17H15F3N2O3S/c1-9-2-4-10(5-3-9)21-14(23)13-11-6-7-25-8-12(11)26-15(13)22-16(24)17(18,19)20/h2-5H,6-8H2,1H3,(H,21,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239473
PNG
(CHEMBL4102064)
Show SMILES FC(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C18H16ClF3N2O2S/c19-10-5-4-6-11(9-10)23-15(25)14-12-7-2-1-3-8-13(12)27-16(14)24-17(26)18(20,21)22/h4-6,9H,1-3,7-8H2,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239453
PNG
(CHEMBL4062500)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)C(F)(F)F)sc2CCCc12
Show InChI InChI=1S/C18H15F5N2O2S/c1-9-5-2-3-7-11(9)24-14(26)13-10-6-4-8-12(10)28-15(13)25-16(27)17(19,20)18(21,22)23/h2-3,5,7H,4,6,8H2,1H3,(H,24,26)(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 6.20E+3n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239427
PNG
(CHEMBL4062416)
Show SMILES CC(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1C
Show InChI InChI=1S/C19H22N2O2S/c1-12-8-6-7-10-15(12)21-18(23)17-14-9-4-3-5-11-16(14)24-19(17)20-13(2)22/h6-8,10H,3-5,9,11H2,1-2H3,(H,20,22)(H,21,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239467
PNG
(CHEMBL4086165)
Show SMILES COc1cc(Nc2ccc(cc2C(O)=O)[N+]([O-])=O)cc2ccccc12
Show InChI InChI=1S/C18H14N2O5/c1-25-17-9-12(8-11-4-2-3-5-14(11)17)19-16-7-6-13(20(23)24)10-15(16)18(21)22/h2-10,19H,1H3,(H,21,22)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16B expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239454
PNG
(CHEMBL4100649)
Show SMILES CCC(=O)Nc1sc2CCCc2c1C(=O)Nc1ccccc1C
Show InChI InChI=1S/C18H20N2O2S/c1-3-15(21)20-18-16(12-8-6-10-14(12)23-18)17(22)19-13-9-5-4-7-11(13)2/h4-5,7,9H,3,6,8,10H2,1-2H3,(H,19,22)(H,20,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239444
PNG
(CHEMBL4088499)
Show SMILES CC(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1OC(F)(F)F
Show InChI InChI=1S/C19H19F3N2O3S/c1-11(25)23-18-16(12-7-3-2-4-10-15(12)28-18)17(26)24-13-8-5-6-9-14(13)27-19(20,21)22/h5-6,8-9H,2-4,7,10H2,1H3,(H,23,25)(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-2


(Homo sapiens)		BDBM50239465
PNG
(CHEMBL4080525 | US11274074, Control [Ani9])
Show SMILES COc1ccccc1\C=N\NC(=O)COc1ccc(Cl)cc1C
Show InChI InChI=1S/C17H17ClN2O3/c1-12-9-14(18)7-8-15(12)23-11-17(21)20-19-10-13-5-3-4-6-16(13)22-2/h3-10H,11H2,1-2H3,(H,20,21)/b19-10+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16B expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239452
PNG
(CHEMBL4084205)
Show SMILES Cc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)F)sc2CCCc12
Show InChI InChI=1S/C17H15F3N2O2S/c1-9-5-2-3-7-11(9)21-14(23)13-10-6-4-8-12(10)25-15(13)22-16(24)17(18,19)20/h2-3,5,7H,4,6,8H2,1H3,(H,21,23)(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239471
PNG
(CHEMBL4081619)
Show SMILES CC(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C18H20N2O2S/c1-12(21)19-18-16(14-10-6-3-7-11-15(14)23-18)17(22)20-13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3,(H,19,21)(H,20,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239429
PNG
(CHEMBL4079765)
Show SMILES FC(F)(F)Oc1ccccc1NC(=O)c1c(NC(=O)C(F)(F)Cl)sc2CCCc12
Show InChI InChI=1S/C17H12ClF5N2O3S/c18-16(19,20)15(27)25-14-12(8-4-3-7-11(8)29-14)13(26)24-9-5-1-2-6-10(9)28-17(21,22)23/h1-2,5-6H,3-4,7H2,(H,24,26)(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239468
PNG
(CHEMBL4073870)
Show SMILES CC(=O)Nc1sc2CCCc2c1C(=O)Nc1ccccc1C
Show InChI InChI=1S/C17H18N2O2S/c1-10-6-3-4-8-13(10)19-16(21)15-12-7-5-9-14(12)22-17(15)18-11(2)20/h3-4,6,8H,5,7,9H2,1-2H3,(H,18,20)(H,19,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239445
PNG
(CHEMBL4060824)
Show SMILES CCC(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1OC(F)(F)F
Show InChI InChI=1S/C20H21F3N2O3S/c1-2-16(26)25-19-17(12-8-4-3-5-11-15(12)29-19)18(27)24-13-9-6-7-10-14(13)28-20(21,22)23/h6-7,9-10H,2-5,8,11H2,1H3,(H,24,27)(H,25,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239434
PNG
(CHEMBL4068320)
Show SMILES CCC(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1C
Show InChI InChI=1S/C20H24N2O2S/c1-3-17(23)22-20-18(14-10-5-4-6-12-16(14)25-20)19(24)21-15-11-8-7-9-13(15)2/h7-9,11H,3-6,10,12H2,1-2H3,(H,21,24)(H,22,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
Anoctamin-1


(Homo sapiens (Human))		BDBM50239440
PNG
(CHEMBL4061287)
Show SMILES FC(F)(F)C(F)(F)C(=O)Nc1sc2CCCCCc2c1C(=O)Nc1ccccc1Cl
Show InChI InChI=1S/C19H16ClF5N2O2S/c20-11-7-4-5-8-12(11)26-15(28)14-10-6-2-1-3-9-13(10)30-16(14)27-17(29)18(21,22)19(23,24)25/h4-5,7-8H,1-3,6,9H2,(H,26,28)(H,27,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of human TMEM16A expressed in FRT cells co-expressing iodide sensitive fluorescent protein YFP-H148Q/I152L/F46L assessed as reduction in A...

J Med Chem 60: 4626-4635 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00020
BindingDB Entry DOI: 10.7270/Q2FT8P5G
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%