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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   108   109   110   111   112   113   114   115   116   117   118   119   120   121   122   123   124   125   127   
128   129   130   132   133   134   135   136   137   138   139   140   141   143   144   145   146   147   148   149   150   
151   153   154   155   156   159   160   161   163   164   165   168   170   171   173   174   176   178   179   183   184   
186   188   189   190   191   192   193   196   198   199   200   203   205   206   207   208   209   210   216   220   224   
226   227   230   232   237   238   241   243   248   252   253   259   261   270   274   276   277   285   291   303   304   
313   318   323   325   328   333   335   337   339   341   353   360   361   365   389   393   398   401   413   433   442   
444   445   446   447   448   451   453   454   455   457   458   460   463   465   467   473   477   478   482   484   499   
504   505   506   517   525   543   549   551   554   591   606   663   691   708   796   804   821   825   833   842   847   
854   855   861   873   879   883   887   913   914   925   926   938   947   1010   1027   1050   1052   1081   1082   1102   1115   
1130   1133   1206   1262   1543   1639   1903   2029   

Compounds Sorted Alphabetically

Compound Name (alphabetical)	Enz. Inhib. Data							ITC Data	Binding Targets	Alternate Compound Names
	Ki	IC50	Kd	EC50	Koff	Kon	Other
BDBM31768	15	132	6	0	0	0	0	0	25-hydroxyvitamin D-1 alpha hydroxylase, mitochondrial Alpha-chymotrypsin Arachidonate 5-lipoxygenase Beta-lactamase AmpC Bile acid transporter Cyclooxygenase Cytochrome P450 11A1 Cytochrome P450 11B1 Cytochrome P450 11B1, mitochondrial Cytochrome P450 11B2 (CYP11B2) Cytochrome P450 17A1 Cytochrome P450 19A1 Cytochrome P450 21 Cytochrome P450 24A1 Cytochrome P450 2A2 Cytochrome P450 2C11 Cytochrome P450 3A Cytochrome P450 51 Cytochrome P450 7A1 Gonadotropin-releasing hormone receptor Heme Oxygenase 1 (HO-1) Heme Oxygenase 2 (HO-2) Indoleamine 2,3-dioxygenase Malate dehydrogenase cytoplasmic P-glycoprotein 1 Phospholipase A2, major isoenzyme Potassium voltage-gated channel subfamily H member 2 Sterol 14α-demethylase (CYP51) Uridine-5'-diphosphoglucuronosyltransferase 1A1 Uridine-5'-diphosphoglucuronosyltransferase 1A4 Uridine-5'-diphosphoglucuronosyltransferase 1A6 Uridine-5'-diphosphoglucuronosyltransferase 2B10 Uridine-5'-diphosphoglucuronosyltransferase 2B7	CHEMBL295698 Ketoconazole Nizoral Panfungol
BDBM50008735	141	12	0	0	0	0	0	0	5-HT1 5-HT3A Serotonin Receptor 5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C 5-hydroxytryptamine receptor 7 (5HT7) ADRA2C Adrenergic receptor alpha-2 Alpha-1A adrenergic receptor Alpha-2A adrenergic receptor D(1A) dopamine receptor D(1B) dopamine receptor D(2) dopamine receptor D(3) dopamine receptor D(4) dopamine receptor DRD1 DRD2 Dopamine D1 receptor Dopamine D1B Dopamine receptor HTR2B HTR3A HTR6 HTR7 Histamine H1 receptor Muscarinic acetylcholine receptor M2 Serotonin (5-HT) receptor Serotonin receptor 2a and 2c (5HT2A and 5HT2C) Sigma non-opioid intracellular receptor 1 Sodium channel protein type I I alpha subunit adrenergic Alpha2	(+)-3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[4,5]cyclohepta[de]pyrido[2,1-a]isoquinolin-3-ol (+)-butaclamol (+/-)-3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[4,5]cyclohepta[de]pyrido[2,1-a]isoquinolin-3-ol (S)-(-)-3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[6,7]cyclohepta[de]pyrido[2,1-a]isoquinolin-3-ol 3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[4,5]cyclohepta[de]pyrido[2,1-a]isoquinolin-3-ol 3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[4,5]cyclohepta[de]pyrido[2,1-a]isoquinolin-3-ol ((+)-butaclamol) 3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[4,5]cyclohepta[de]pyrido[2,1-a]isoquinolin-3-ol((+)-butaclamol) 3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[6,7]cyclohepta[de]pyrido[2,1-a]isoquinolin-3-ol(Butaclamol) BUTACLAMOL BUTACLAMOL, (-) BUTACLAMOL,(+) BUTACLAMOL,d- CHEMBL8514 d-Butaclamol