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PubMed code 22784640

Compile data set for download or QSAR
Found 36 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
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397852
PNG
(CHEMBL2179510)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3OS/c1-15-27-24(30-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-31-19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
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n/an/a 1.5n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397879
PNG
(CHEMBL2179493)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCCc3c3cc(ccc23)[N+]([O-])=O)n1
Show InChI InChI=1S/C23H28N4O3/c1-3-16-14-17(4-2)25-23(24-16)30-13-7-12-26-21-9-6-5-8-19(21)20-15-18(27(28)29)10-11-22(20)26/h10-11,14-15H,3-9,12-13H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397855
PNG
(CHEMBL2179485)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCC(=O)c3c3cc(ccc23)-c2nc(C)no2)n1
Show InChI InChI=1S/C26H29N5O3/c1-4-18-15-19(5-2)29-26(28-18)33-13-7-12-31-21-11-10-17(25-27-16(3)30-34-25)14-20(21)24-22(31)8-6-9-23(24)32/h10-11,14-15H,4-9,12-13H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397869
PNG
(CHEMBL2179502)
Show SMILES CN(C)S(=O)(=O)CCCn1c2CCCCc2c2cc(ccc12)-c1nc(C)no1
Show InChI InChI=1S/C20H26N4O3S/c1-14-21-20(27-22-14)15-9-10-19-17(13-15)16-7-4-5-8-18(16)24(19)11-6-12-28(25,26)23(2)3/h9-10,13H,4-8,11-12H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397861
PNG
(CHEMBL2179511)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3ccc(F)c(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3OS/c1-15-27-24(30-28-15)16-7-10-23-19(13-16)18-5-2-3-6-22(18)29(23)11-4-12-31-17-8-9-20(25)21(26)14-17/h7-10,13-14H,2-6,11-12H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397867
PNG
(CHEMBL2179504)
Show SMILES Cc1cc(C)nc(OCCCn2c3CCCCc3c3cc(ccc23)-c2ncco2)n1
Show InChI InChI=1S/C24H26N4O2/c1-16-14-17(2)27-24(26-16)30-12-5-11-28-21-7-4-3-6-19(21)20-15-18(8-9-22(20)28)23-25-10-13-29-23/h8-10,13-15H,3-7,11-12H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397885
PNG
(CHEMBL1914885)
Show SMILES COC(=O)c1ccc2n(CCCOc3nc(C)cc(C)n3)c3CCCCc3c2c1
Show InChI InChI=1S/C23H27N3O3/c1-15-13-16(2)25-23(24-15)29-12-6-11-26-20-8-5-4-7-18(20)19-14-17(22(27)28-3)9-10-21(19)26/h9-10,13-14H,4-8,11-12H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397852
PNG
(CHEMBL2179510)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3OS/c1-15-27-24(30-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-31-19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
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n/an/a 1.5n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 1a entry into human HuH7.5 cells by immunoblotting

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397857
PNG
(CHEMBL2179515)
Show SMILES Cc1noc(n1)-c1ccc2n(CC(F)COc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H22F3N3O2/c1-14-28-24(32-29-14)15-6-7-23-21(8-15)20-4-2-3-5-22(20)30(23)12-18(27)13-31-19-10-16(25)9-17(26)11-19/h6-11,18H,2-5,12-13H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397858
PNG
(CHEMBL2179514)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCc3nc4ccc(F)cc4[nH]3)c3CCCCc3c2c1
Show InChI InChI=1S/C25H24FN5O/c1-15-27-25(32-30-15)16-8-11-23-19(13-16)18-5-2-3-6-22(18)31(23)12-4-7-24-28-20-10-9-17(26)14-21(20)29-24/h8-11,13-14H,2-7,12H2,1H3,(H,28,29)
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397863
PNG
(CHEMBL2179508)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCOc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3O2/c1-15-27-24(31-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-30-19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397864
PNG
(CHEMBL2179507)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCCc3c3cc(ccc23)-n2cnnn2)n1
Show InChI InChI=1S/C24H29N7O/c1-3-17-14-18(4-2)27-24(26-17)32-13-7-12-30-22-9-6-5-8-20(22)21-15-19(10-11-23(21)30)31-16-25-28-29-31/h10-11,14-16H,3-9,12-13H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397871
PNG
(CHEMBL2179500)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCCc3c3cc(ccc23)-c2nc(C)no2)n1
Show InChI InChI=1S/C26H31N5O2/c1-4-19-16-20(5-2)29-26(28-19)32-14-8-13-31-23-10-7-6-9-21(23)22-15-18(11-12-24(22)31)25-27-17(3)30-33-25/h11-12,15-16H,4-10,13-14H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397862
PNG
(CHEMBL2179509)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCOc3ccc(F)c(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3O2/c1-15-27-24(31-28-15)16-7-10-23-19(13-16)18-5-2-3-6-22(18)29(23)11-4-12-30-17-8-9-20(25)21(26)14-17/h7-10,13-14H,2-6,11-12H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397870
PNG
(CHEMBL2179501)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCOc3nc(C)cc(n3)C(F)(F)F)c3CCCCc3c2c1
Show InChI InChI=1S/C24H24F3N5O2/c1-14-12-21(24(25,26)27)30-23(28-14)33-11-5-10-32-19-7-4-3-6-17(19)18-13-16(8-9-20(18)32)22-29-15(2)31-34-22/h8-9,12-13H,3-7,10-11H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397872
PNG
(CHEMBL2179499)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCOc3nc(C)cc(C)n3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H27N5O2/c1-15-13-16(2)26-24(25-15)30-12-6-11-29-21-8-5-4-7-19(21)20-14-18(9-10-22(20)29)23-27-17(3)28-31-23/h9-10,13-14H,4-8,11-12H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397860
PNG
(CHEMBL2179512)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCS(=O)(=O)c3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3O3S/c1-15-27-24(32-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-33(30,31)19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397856
PNG
(CHEMBL2179106)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCC(=O)c3c2c1
Show InChI InChI=1S/C24H21F2N3O2S/c1-14-27-24(31-28-14)15-6-7-20-19(10-15)23-21(4-2-5-22(23)30)29(20)8-3-9-32-18-12-16(25)11-17(26)13-18/h6-7,10-13H,2-5,8-9H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397874
PNG
(CHEMBL2179497)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCCc3c3cc(ccc23)-c2noc(C)n2)n1
Show InChI InChI=1S/C26H31N5O2/c1-4-19-16-20(5-2)29-26(28-19)32-14-8-13-31-23-10-7-6-9-21(23)22-15-18(11-12-24(22)31)25-27-17(3)33-30-25/h11-12,15-16H,4-10,13-14H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397884
PNG
(CHEMBL2179488)
Show SMILES COc1cc(OC)nc(NCCCn2c3CCCCc3c3cc(ccc23)S(C)(=O)=O)n1
Show InChI InChI=1S/C22H28N4O4S/c1-29-20-14-21(30-2)25-22(24-20)23-11-6-12-26-18-8-5-4-7-16(18)17-13-15(31(3,27)28)9-10-19(17)26/h9-10,13-14H,4-8,11-12H2,1-3H3,(H,23,24,25)
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n/an/a 10n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397873
PNG
(CHEMBL2179498)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCCc3c3cc(ccc23)-c2nnc(C)o2)n1
Show InChI InChI=1S/C26H31N5O2/c1-4-19-16-20(5-2)28-26(27-19)32-14-8-13-31-23-10-7-6-9-21(23)22-15-18(11-12-24(22)31)25-30-29-17(3)33-25/h11-12,15-16H,4-10,13-14H2,1-3H3
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n/an/a 15n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397854
PNG
(CHEMBL2179486)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCC(F)(F)Cc3c2c1
Show InChI InChI=1S/C24H21F4N3OS/c1-14-29-23(32-30-14)15-3-4-21-19(9-15)20-13-24(27,28)6-5-22(20)31(21)7-2-8-33-18-11-16(25)10-17(26)12-18/h3-4,9-12H,2,5-8,13H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397853
PNG
(CHEMBL2179487)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCC(F)(F)Cc3c3cc(ccc23)-c2nc(C)no2)n1
Show InChI InChI=1S/C26H29F2N5O2/c1-4-18-14-19(5-2)31-25(30-18)34-12-6-11-33-22-8-7-17(24-29-16(3)32-35-24)13-20(22)21-15-26(27,28)10-9-23(21)33/h7-8,13-14H,4-6,9-12,15H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397877
PNG
(CHEMBL2177128)
Show SMILES Cc1cc(C)nc(OCCCn2c3CCCCc3c3cc(ccc23)C#N)n1
Show InChI InChI=1S/C22H24N4O/c1-15-12-16(2)25-22(24-15)27-11-5-10-26-20-7-4-3-6-18(20)19-13-17(14-23)8-9-21(19)26/h8-9,12-13H,3-7,10-11H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397865
PNG
(CHEMBL2179506)
Show SMILES CCCc1cn(nn1)-c1ccc2n(CCCOc3nc(CC)cc(CC)n3)c3CCCCc3c2c1
Show InChI InChI=1S/C28H36N6O/c1-4-10-22-19-34(32-31-22)23-13-14-27-25(18-23)24-11-7-8-12-26(24)33(27)15-9-16-35-28-29-20(5-2)17-21(6-3)30-28/h13-14,17-19H,4-12,15-16H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397859
PNG
(CHEMBL2179513)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCS(=O)c3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3O2S/c1-15-27-24(31-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-32(30)19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
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n/an/a 15n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397878
PNG
(CHEMBL2179494)
Show SMILES COc1cc(OC)nc(NCCCn2c3CCCCc3c3cc(ccc23)C#N)n1
Show InChI InChI=1S/C22H25N5O2/c1-28-20-13-21(29-2)26-22(25-20)24-10-5-11-27-18-7-4-3-6-16(18)17-12-15(14-23)8-9-19(17)27/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,24,25,26)
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n/an/a 15n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397882
PNG
(CHEMBL2179490)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCCc3c3cc(ccc23)S(C)(=O)=O)n1
Show InChI InChI=1S/C24H31N3O3S/c1-4-17-15-18(5-2)26-24(25-17)30-14-8-13-27-22-10-7-6-9-20(22)21-16-19(31(3,28)29)11-12-23(21)27/h11-12,15-16H,4-10,13-14H2,1-3H3
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n/an/a 30n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397875
PNG
(CHEMBL2179496)
Show SMILES N#Cc1ccc2n(CCCc3nc4ccccc4[nH]3)c3CCCCc3c2c1
Show InChI InChI=1S/C23H22N4/c24-15-16-11-12-22-18(14-16)17-6-1-4-9-21(17)27(22)13-5-10-23-25-19-7-2-3-8-20(19)26-23/h2-3,7-8,11-12,14H,1,4-6,9-10,13H2,(H,25,26)
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n/an/a 50n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397880
PNG
(CHEMBL2179492)
Show SMILES CS(=O)(=O)c1ccc2n(CCCc3nc4ccccc4[nH]3)c3CCCCc3c2c1
Show InChI InChI=1S/C23H25N3O2S/c1-29(27,28)16-12-13-22-18(15-16)17-7-2-5-10-21(17)26(22)14-6-11-23-24-19-8-3-4-9-20(19)25-23/h3-4,8-9,12-13,15H,2,5-7,10-11,14H2,1H3,(H,24,25)
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397876
PNG
(CHEMBL2179495)
Show SMILES CN(C)S(=O)(=O)CCCn1c2CCCCc2c2cc(ccc12)C#N
Show InChI InChI=1S/C18H23N3O2S/c1-20(2)24(22,23)11-5-10-21-17-7-4-3-6-15(17)16-12-14(13-19)8-9-18(16)21/h8-9,12H,3-7,10-11H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397866
PNG
(CHEMBL2179505)
Show SMILES CCc1cc(CC)nc(OCCCn2c3CCCCc3c3cc(ccc23)-n2cc(CF)nn2)n1
Show InChI InChI=1S/C26H31FN6O/c1-3-18-14-19(4-2)29-26(28-18)34-13-7-12-32-24-9-6-5-8-22(24)23-15-21(10-11-25(23)32)33-17-20(16-27)30-31-33/h10-11,14-15,17H,3-9,12-13,16H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397868
PNG
(CHEMBL2179503)
Show SMILES Cc1cc(C)nc(OCCCn2c3CCCCc3c3cc(ccc23)C2=NCCO2)n1 |t:27|
Show InChI InChI=1S/C24H28N4O2/c1-16-14-17(2)27-24(26-16)30-12-5-11-28-21-7-4-3-6-19(21)20-15-18(8-9-22(20)28)23-25-10-13-29-23/h8-9,14-15H,3-7,10-13H2,1-2H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397883
PNG
(CHEMBL2179489)
Show SMILES Cc1cc(C)nc(OCCCn2c3CCCCc3c3cc(ccc23)S(C)(=O)=O)n1
Show InChI InChI=1S/C22H27N3O3S/c1-15-13-16(2)24-22(23-15)28-12-6-11-25-20-8-5-4-7-18(20)19-14-17(29(3,26)27)9-10-21(19)25/h9-10,13-14H,4-8,11-12H2,1-3H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Scavenger receptor class B member 1


(Homo sapiens (Human))		BDBM50397881
PNG
(CHEMBL2179491)
Show SMILES CN(C)S(=O)(=O)CCCn1c2CCCCc2c2cc(ccc12)S(C)(=O)=O
Show InChI InChI=1S/C18H26N2O4S2/c1-19(2)26(23,24)12-6-11-20-17-8-5-4-7-15(17)16-13-14(25(3,21)22)9-10-18(16)20/h9-10,13H,4-8,11-12H2,1-3H3
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n/an/a 500n/an/an/an/an/an/a



iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human SRB1-mediated Hepatitis C virus genotype 2a entry into human HuH7.5 cells by luciferase reporter gene assay

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50397852
PNG
(CHEMBL2179510)
Show SMILES Cc1noc(n1)-c1ccc2n(CCCSc3cc(F)cc(F)c3)c3CCCCc3c2c1
Show InChI InChI=1S/C24H23F2N3OS/c1-15-27-24(30-28-15)16-7-8-23-21(11-16)20-5-2-3-6-22(20)29(23)9-4-10-31-19-13-17(25)12-18(26)14-19/h7-8,11-14H,2-6,9-10H2,1H3
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iTherX Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human ERG

Bioorg Med Chem Lett 22: 4955-61 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.038
BindingDB Entry DOI: 10.7270/Q20R9QH1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%