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Compound Name:

Compounds Sorted by Binding Data per Compound

1   2   3   4   5   6   7   8   9   10   11   12   13   14   15   16   17   18   19   20   21   
22   23   24   25   26   27   28   29   30   31   32   33   34   35   36   37   38   39   40   41   42   
43   44   45   46   47   48   49   50   51   52   53   54   55   56   57   58   59   60   61   62   63   
64   65   66   67   68   69   70   71   72   73   74   75   76   77   78   79   80   81   82   83   84   
85   86   87   88   89   90   91   92   93   94   95   96   97   98   99   100   101   102   103   104   105   
106   107   109   110   111   112   113   114   118   119   120   121   122   123   124   125   126   127   128   130   131   
134   136   137   138   139   140   141   146   147   148   150   152   153   154   156   157   158   159   160   161   162   
163   164   165   166   168   169   171   172   173   179   185   186   188   190   194   195   199   205   207   208   212   
219   221   222   223   224   225   226   233   241   243   255   261   277   285   291   293   303   305   307   324   326   
330   333   335   336   337   341   357   360   366   386   389   411   442   443   444   445   446   447   448   450   453   
454   456   458   459   460   461   463   465   467   469   482   496   505   511   515   516   526   529   539   555   581   
773   790   804   821   824   831   837   839   847   849   853   855   868   871   880   913   922   923   931   938   960   
965   989   995   997   1013   1027   1054   1096   1125   1196   1353   1429   1598   

Compounds Sorted Alphabetically

Compound Name (alphabetical)	Enz. Inhib. Data							ITC Data	Binding Targets	Alternate Compound Names
	Ki	IC50	Kd	EC50	Koff	Kon	Other
BDBM35804	74	1	12	18	0	0	0	0	Adenosine A1 receptor Adenosine A2 receptor Adenosine Receptors A2a (A2a) Adenosine receptor A1 Adenosine receptor A2 Adenosine receptor A2a and A3 Adenosine receptor A2b Adenosine receptor A3	(CGS21680) 3-(4-{2-[6-Amino-9-(5-ethylcarbamoylmethyl-3,4-dihydroxy-tetrahydro-furan-2-yl)-9H-purin-2-ylamino]-ethyl}-phenyl)-propionic acid 2-[4-(2-carboxyethyl)-phenethylamino]-5''''-N-ethylcarboxamidoadenosine 2-[4-(2-carboxyethyl)phenethylamino]-5''''-N-ethylcarboxamidoadenosine 2-p-(2-carboxyethyl)phenethylamino-5''''-N-ethylcarboxamidoadenosine 3-(4-(2-(6-amino-9-((2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxy-tetrahydrofuran-2-yl)-9H-purin-2-ylamino)ethyl)phenyl)propanoic acid 3-(4-(2-(6-amino-9-((2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxytetrahydrofuran-2-yl)-9H-purin-2-ylamino)ethyl)phenyl)propanoic acid 3-(4-{2-[6-Amino-9-((2R,3R,4S,5S)-5-ethylcarbamoyl-3,4-dihydroxy-tetrahydro-furan-2-yl)-9H-purin-2-ylamino]-ethyl}-phenyl)-propionic acid CGS 21680 CGS-21680 CHEMBL331372 [3H]-CGS 21680
BDBM520	52	31	2	0	1	1	0	1	ATP-binding cassette sub-family G member 2 Adrenergic Alpha Cytochrome P450 1A Cytochrome P450 2B6 Cytochrome P450 2C19 Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 3A Cytochrome P450 3A5 (CYP3A5) HIV-1 Protease HIV-1 Protease A Subtype HIV-1 Protease A Subtype Mutant (V82F/I84V) HIV-1 Protease AE HIV-1 Protease AE Mutant (V82F) HIV-1 Protease AE-P HIV-1 Protease AE-P Mutant (F82V) HIV-1 Protease B Subtype HIV-1 Protease B Subtype Mutant (V82F) HIV-1 Protease B Subtype Mutant (V82F/I84V) HIV-1 Protease C Subtype HIV-1 Protease C Subtype Mutant (V82F/I84V) HIV-1 Protease Mutant (A71V) HIV-1 Protease Mutant (D30N) HIV-1 Protease Mutant (D30N/A71V) HIV-1 Protease Mutant (D30N/M36I) HIV-1 Protease Mutant (D30N/M36I/A71V) HIV-1 Protease Mutant (L10I/L90M) HIV-1 Protease Mutant (M36I) HIV-1 Protease Mutant (M36I/A71V) HIV-1 Protease Mutant (M46I/I54V) HIV-1 Protease Mutant (V82A/I84V) HIV-1 Protease Mutant (V82F/I84V) HIV-1 Protease Mutant M1 (L10I, G48V, I54V, L63P, V82A) HIV-1 Protease Mutant M2 (D30N, L63P, N88D) HIV-1 Protease Mutant M3 (L10I, L63P, A71V, G73S, I84V, L90M) HIV-1 Protease Mutant V6 HIV-1 Protease Mutant V6(46) HIV-1 Protease Mutant V6(46/54/84) HIV-1 Protease Mutant V6(46/84) HIV-1 Protease Mutant V6(54) HIV-1 Protease Mutant V6(54/84) HIV-1 Protease Mutant V6(84) HIV-1 Protease Mutant, A-1 HIV-1 Protease Mutant, ANAM-11 HIV-1 Protease Mutant, MDR-HM HIV-1 Protease Mutant, MDR-QM HIV-1 Protease Mutant, NAM-10 HIV-1 protease Human immunodeficiency virus type 1 protease Multidrug and toxin extrusion protein 1 Multidrug and toxin extrusion protein 2 P-glycoprotein (P-gp) P-glycoprotein 1 P-glycoprotein 1 and 3 (MDR1a/MDR1b) Solute carrier family 22 member 2 Solute carrier family 22 member 3 Solute carrier organic anion transporter family member 1B1 (OATP1B1) Solute carrier organic anion transporter family member 1B3 (OATP1B3) Solute carrier organic anion transporter family member 2B1	1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[(2S)-3-methyl-2-{[methyl({[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl})carbamoyl]amino}butanamido]-1,6-diphenylhexan-2-yl]carbamate ABT-538 CHEMBL163 Norvir RTV Ritonavir