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64 similar compounds to monomer 1434

Compile data set for download or QSAR
Wt: 342.3
BDBM1603
Wt: 358.3
BDBM1604
Wt: 388.4
BDBM1605
Wt: 372.4
BDBM1606
Wt: 278.3
BDBM1607
Wt: 354.4
BDBM1608
Wt: 350.3
BDBM1609
Wt: 322.3
BDBM1610
Wt: 356.4
BDBM1611
Wt: 352.3
BDBM1612
Wt: 324.3
BDBM1613
Wt: 284.2
BDBM1623
Wt: 282.2
BDBM1659
Wt: 240.2
BDBM1651
Wt: 252.2
BDBM1652
Displayed 1 to 15 (of 64 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 1603,1604,1605,1606,1607,1608,1609,1610,1611,1612,1613,1623,1659,1651,1652   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1603
PNG
(1 1-Cyclopropyl-5,1 l-dihydro-4-(phenylmethyl)-6H-...)
Show SMILES O=C1Nc2c(Cc3ccccc3)ccnc2N(C2CC2)c2ncccc12
Show InChI InChI=1S/C21H18N4O/c26-21-17-7-4-11-22-19(17)25(16-8-9-16)20-18(24-21)15(10-12-23-20)13-14-5-2-1-3-6-14/h1-7,10-12,16H,8-9,13H2,(H,24,26)
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n/an/a 140n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM1652
PNG
(2-cyclopropyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3...)
Show SMILES O=C1Nc2cccnc2N(C2CC2)c2ncccc12
Show InChI InChI=1S/C14H12N4O/c19-14-10-3-1-7-15-12(10)18(9-5-6-9)13-11(17-14)4-2-8-16-13/h1-4,7-9H,5-6H2,(H,17,19)
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n/an/a 450n/an/an/an/an/an/a



Yale University

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 reverse transcriptase at 37 degree Centigrade


J Med Chem 44: 145-54 (2001)


Article DOI: 10.1021/jm000255n
BindingDB Entry DOI: 10.7270/Q2VX0FRX
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1605
PNG
(11-C yclopropyl-5,11 -dihydro-4-[ (2-hydroxy-5-met...)
Show SMILES COc1ccc(O)c(Cc2ccnc3N(C4CC4)c4ncccc4C(=O)Nc23)c1
Show InChI InChI=1S/C22H20N4O3/c1-29-16-6-7-18(27)14(12-16)11-13-8-10-24-21-19(13)25-22(28)17-3-2-9-23-20(17)26(21)15-4-5-15/h2-3,6-10,12,15,27H,4-5,11H2,1H3,(H,25,28)
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n/an/a 850n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1606
PNG
(2-cyclopropyl-7-[(2-hydroxy-4-methylphenyl)methyl]...)
Show SMILES Cc1ccc(Cc2ccnc3N(C4CC4)c4ncccc4C(=O)Nc23)c(O)c1
Show InChI InChI=1S/C22H20N4O2/c1-13-4-5-14(18(27)11-13)12-15-8-10-24-21-19(15)25-22(28)17-3-2-9-23-20(17)26(21)16-6-7-16/h2-5,8-11,16,27H,6-7,12H2,1H3,(H,25,28)
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n/an/a 200n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1607
PNG
(2-cyclopropyl-7-ethenyl-2,4,9,15-tetraazatricyclo[...)
Show SMILES C=Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12
Show InChI InChI=1S/C16H14N4O/c1-2-10-7-9-18-15-13(10)19-16(21)12-4-3-8-17-14(12)20(15)11-5-6-11/h2-4,7-9,11H,1,5-6H2,(H,19,21)
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n/an/a 110n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1608
PNG
(11-Cyclopropyl-5,l l-dihydro-4-(2-phenylethenyl)-6...)
Show SMILES O=C1Nc2c(\C=C\c3ccccc3)ccnc2N(C2CC2)c2ncccc12
Show InChI InChI=1S/C22H18N4O/c27-22-18-7-4-13-23-20(18)26(17-10-11-17)21-19(25-22)16(12-14-24-21)9-8-15-5-2-1-3-6-15/h1-9,12-14,17H,10-11H2,(H,25,27)/b9-8+
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n/an/an/an/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1609
PNG
(4-(2-Carbethoxyethenyl)- 11-cyclopropyl-5,1 l-dihy...)
Show SMILES CCOC(=O)\C=C/c1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12
Show InChI InChI=1S/C19H18N4O3/c1-2-26-15(24)8-5-12-9-11-21-18-16(12)22-19(25)14-4-3-10-20-17(14)23(18)13-6-7-13/h3-5,8-11,13H,2,6-7H2,1H3,(H,22,25)/b8-5-
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n/an/an/an/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1610
PNG
((2Z)-3-{2-cyclopropyl-10-oxo-2,4,9,15-tetraazatric...)
Show SMILES OC(=O)\C=C/c1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12
Show InChI InChI=1S/C17H14N4O3/c22-13(23)6-3-10-7-9-19-16-14(10)20-17(24)12-2-1-8-18-15(12)21(16)11-4-5-11/h1-3,6-9,11H,4-5H2,(H,20,24)(H,22,23)/b6-3-
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n/an/an/an/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1611
PNG
(11-Cyclopropyl-5,1 l-dihydr0-4-(2-phenylethyl)-6H-...)
Show SMILES O=C1Nc2c(CCc3ccccc3)ccnc2N(C2CC2)c2ncccc12
Show InChI InChI=1S/C22H20N4O/c27-22-18-7-4-13-23-20(18)26(17-10-11-17)21-19(25-22)16(12-14-24-21)9-8-15-5-2-1-3-6-15/h1-7,12-14,17H,8-11H2,(H,25,27)
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n/an/an/an/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1612
PNG
(4-(2-Carbethoxyethyl)-1l-cyclopropyl-5,1 l-dihydro...)
Show SMILES CCOC(=O)CCc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12
Show InChI InChI=1S/C19H20N4O3/c1-2-26-15(24)8-5-12-9-11-21-18-16(12)22-19(25)14-4-3-10-20-17(14)23(18)13-6-7-13/h3-4,9-11,13H,2,5-8H2,1H3,(H,22,25)
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n/an/an/an/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1613
PNG
(3-{2-cyclopropyl-10-oxo-2,4,9,15-tetraazatricyclo[...)
Show SMILES OC(=O)CCc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12
Show InChI InChI=1S/C17H16N4O3/c22-13(23)6-3-10-7-9-19-16-14(10)20-17(24)12-2-1-8-18-15(12)21(16)11-4-5-11/h1-2,7-9,11H,3-6H2,(H,20,24)(H,22,23)
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n/an/an/an/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1623
PNG
(2-ethyl-5-hydroxy-10-oxo-2,4,9,15-tetraazatricyclo...)
Show SMILES CCN1c2ncccc2C(=O)Nc2c(C=O)cc(=O)[nH]c12
Show InChI InChI=1S/C14H12N4O3/c1-2-18-12-9(4-3-5-15-12)14(21)17-11-8(7-19)6-10(20)16-13(11)18/h3-7H,2H2,1H3,(H,16,20)(H,17,21)
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n/an/an/an/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1651
PNG
(2-ethyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pe...)
Show SMILES CCN1c2ncccc2NC(=O)c2cccnc12
Show InChI InChI=1S/C13H12N4O/c1-2-17-11-9(5-3-7-14-11)13(18)16-10-6-4-8-15-12(10)17/h3-8H,2H2,1H3,(H,16,18)
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n/an/a 440n/an/an/an/a7.822



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 34: 2231-41 (1991)


Article DOI: 10.1021/jm00111a045
BindingDB Entry DOI: 10.7270/Q2TT4P4X
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1652
PNG
(2-cyclopropyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3...)
Show SMILES O=C1Nc2cccnc2N(C2CC2)c2ncccc12
Show InChI InChI=1S/C14H12N4O/c19-14-10-3-1-7-15-12(10)18(9-5-6-9)13-11(17-14)4-2-8-16-13/h1-4,7-9H,5-6H2,(H,17,19)
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n/an/a 450n/an/an/an/a7.822



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 34: 2231-41 (1991)


Article DOI: 10.1021/jm00111a045
BindingDB Entry DOI: 10.7270/Q2TT4P4X
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1659
PNG
(9-acetyl-2-ethyl-2,4,9,15-tetraazatricyclo[9.4.0.0...)
Show SMILES CCN1c2ncccc2N(C(C)=O)C(=O)c2cccnc12
Show InChI InChI=1S/C15H14N4O2/c1-3-18-13-11(6-4-8-16-13)15(21)19(10(2)20)12-7-5-9-17-14(12)18/h4-9H,3H2,1-2H3
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n/an/a 360n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 34: 2231-41 (1991)


Article DOI: 10.1021/jm00111a045
BindingDB Entry DOI: 10.7270/Q2TT4P4X
More data for this
Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM1651
PNG
(2-ethyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pe...)
Show SMILES CCN1c2ncccc2NC(=O)c2cccnc12
Show InChI InChI=1S/C13H12N4O/c1-2-17-11-9(5-3-7-14-11)13(18)16-10-6-4-8-15-12(10)17/h3-8H,2H2,1H3,(H,16,18)
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n/an/a 440n/an/an/an/an/an/a



Yale University

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 reverse transcriptase at 37 degree Centigrade


J Med Chem 44: 145-54 (2001)


Article DOI: 10.1021/jm000255n
BindingDB Entry DOI: 10.7270/Q2VX0FRX
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1604
PNG
(1 1 -C yclopropyl-5,ll -dihydro-4- [ (2-hydroxyphe...)
Show SMILES Oc1ccccc1Cc1ccnc2N(C3CC3)c3ncccc3C(=O)Nc12
Show InChI InChI=1S/C21H18N4O2/c26-17-6-2-1-4-13(17)12-14-9-11-23-20-18(14)24-21(27)16-5-3-10-22-19(16)25(20)15-7-8-15/h1-6,9-11,15,26H,7-8,12H2,(H,24,27)
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n/an/a 190n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals Inc



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4839-47 (1995)


Article DOI: 10.1021/jm00024a011
BindingDB Entry DOI: 10.7270/Q2ZK5DV7
More data for this
Ligand-Target Pair