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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. DataITC DataBinding TargetsAlternate Compound Names
KiIC50KdEC50KoffKonOther
BDBM50004665
PNG
50252120000
  • Acetylcholinesterase
  • Cholinergic, muscarinic
  • MCOLN3 protein
  • Muscarinic acetylcholine receptor
  • Muscarinic acetylcholine receptor DM1
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M2 and M4
  • Muscarinic acetylcholine receptor M2 and M5
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Muscarinic acetylcholine receptor M5
  • Serotonin (5-HT) receptor
  • transient receptor potential cation channel, subfamily N, member 1
  • (oxotremorine)1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyrrolidin-2-one
  • 1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyrrolidin-2-one
  • 1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyrrolidin-2-one (oxotremorphine)
  • 1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyrrolidin-2-one(Oxotremorine)
  • 1-[4-(2-oxo-pyrrolidin-1-yl)-but-2-ynyl]-pyrrolidinium
  • CHEMBL7634
  • Oxotremorine
  • Oxotremorine1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyrrolidin-2-one
  • cid_4630
BDBM50116766
PNG
6291170000
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 3A
  • 5-hydroxytryptamine receptor 5A
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Adrenergic receptor
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Beta-2 adrenergic receptor
  • Beta-2 adrenergic receptor and beta-3 adrenergic receptor
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cystic fibrosis transmembrane conductance regulator
  • D(1A) dopamine receptor
  • D(1B) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • DRD1
  • Delta-type opioid receptor
  • Dopamine receptor
  • Histamine H2 receptor
  • Histamine receptor (H3 and H4)
  • Multidrug resistance-associated protein 4
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M1 and M3
  • Muscarinic acetylcholine receptor M2 and M5
  • Serotonin (5-HT) receptor
  • Sigma non-opioid intracellular receptor 1
  • (-)-Pramipexole
  • (6S)-N(6)-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine
  • 2,6-Benzothiazolediamine, 4,5,6,7-tetrahydro-N(sup 6)-propyl-, (S)-
  • CHEMBL301265
  • PRAMIPEXOLE
  • cid_119570
BDBM50240772
PNG
875420000
  • Alpha-1A adrenergic receptor
  • Amine oxidase (flavin-containing) A
  • Amine oxidase [flavin-containing] B
  • Bile salt export pump
  • Cytochrome P450 2A13
  • Cytochrome P450 2A6
  • Cytochrome P450 2B6
  • Cytochrome P450 2C19
  • D(3) dopamine receptor
  • G-protein subunit alpha-16
  • Histone Lysine Demethylase
  • Homo sapiens lysine demethylase 2A (KDM2A)
  • LSD1/CoREST complex
  • Lysine-specific demethylase 3A
  • Lysine-specific demethylase 4C
  • Lysine-specific demethylase 5C
  • Lysine-specific demethylase 6B
  • Lysine-specific histone demethylase 1A
  • Lysine-specific histone demethylase 1A/REST corepressor
  • Lysine-specific histone demethylase 1B
  • trace amine-associated receptor 1
  • (1R,2S)-(-)-2-phenylcyclopropylamine
  • (1R,2S)-2-phenylcyclopropanamine
  • (tranylcypromine)2-Phenyl-cyclopropylamine
  • 2-Phenyl-cyclopropylamine
  • CHEMBL1179
  • Parnate
  • TRANYLCYPROMINE
  • TRANYLCYPROMINE HYDROCHLORIDE
  • US10836743, Compound TCP
  • US8993808, Tranylcypromine
  • US9180183, Tranylcypromine
  • cid_2723716
  • rel-Tranylcypromine
BDBM519
PNG
3532201101
  • ATP-binding cassette sub-family G member 2
  • Chloroquine resistance transporter
  • Cytochrome P450 3A
  • Gag polyprotein
  • 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 (L10I/L90M)
  • 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, 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
  • P-glycoprotein (P-gp)
  • P-glycoprotein 1
  • P-glycoprotein 1 and 3 (MDR1a/MDR1b)
  • (2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-decahydroisoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinolin-2-ylformamido)butanediamide
  • CHEMBL114
  • Fortovase
  • Invirase
  • Ro 31-8959
  • SQV
  • Saquinavir
BDBM77970
PNG
5926130000
  • 3C-like proteinase
  • 3C-like proteinase (3CL-PRO)
  • 5-HT3A Serotonin Receptor
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1B
  • 5-hydroxytryptamine receptor 1D
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 6
  • Adrenergic Alpha
  • Adrenergic receptor alpha-2
  • Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Bile salt export pump
  • Calcium channel
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Envelope glycoprotein
  • HTR6
  • Histamine H1 receptor
  • Histamine H2 receptor
  • Monoamine transporter
  • Multidrug resistance-associated protein 4
  • Norepinephrine Monoamine transporters
  • Norepinephrine transporter
  • Proteasome subunit alpha type-6
  • SLC6A4
  • Serotonin (5-HT) receptor
  • Serotonin 1 (5-HT1) receptor
  • Serotonin 2 (5-HT2) receptor
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sodium channel protein type I I alpha subunit
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • TPA: Essential protein of the mitochondrial intermembrane space
  • Trypanothione Reductase (TryR)
  • Trypanothione reductase
  • adrenergic Alpha2
  • 3-(2-chloranyl-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethyl-propan-1-amine;hydrochloride
  • 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethyl-1-propanamine;hydrochloride
  • 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine;hydrochloride
  • 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl-dimethyl-amine;hydrochloride
  • CHLORIMIPRAMINE
  • CLOMIPRAMINE
  • CLOMIPRAMINE HYDROCHLORIDE
  • CLOMIPRIMINE
  • MLS000028511
  • SMR000058295
  • cid_68539
  • med.21724, Compound Clomipramine
BDBM8125
PNG
5524190000
  • Calcium channel (Type L)
  • HIV WT-A pol protein (wild-type clade A)
  • HIV WT-B pol protein (wild-type clade B)
  • HIV WT-C pol protein (wild-type clade C)
  • HIV-1 Protease
  • HIV-1 Protease Mutant (D30N)
  • HIV-1 Protease Mutant (I50V)
  • HIV-1 Protease Mutant (I84V)
  • HIV-1 Protease Mutant (L90M)
  • HIV-1 Protease Mutant (V82A)
  • HIV-1 isolate WT-control pol protein (CNDO control strain)
  • HIV-1 protease
  • HIV-1 protease (Wt)
  • HIV-1 protease M1
  • HIV-1 protease M2
  • HIV-1 protease M3
  • Human immunodeficiency virus type 1 protease
  • MDR1
  • MDRC4
  • Multidrug resistance protein 1/Multidrug resistance associated protein 1
  • P-glycoprotein 1
  • Potassium voltage-gated channel subfamily H member 2
  • Protease
  • Sodium channel protein type 5 subunit alpha
  • Voltage-gated potassium channel beta subunit Mink/subunit Kv7.1
  • Voltage-gated potassium channel subunit Kv4.3
  • (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl N-[(2S,3R)-4-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-3-hydroxy-1-phenylbutan-2-yl]carbamate
  • CHEMBL1323
  • Darunavir
  • Darunavir (DRV)
  • TMC-114
  • UIC-94017
  • US10806794, Compound Darunavir
BDBM8610
PNG
874700000
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Cytochrome P450
  • Cytochrome P450 11B1, mitochondrial
  • Cytochrome P450 11B2 (CYP11B2)
  • Cytochrome P450 125 (CYP125)
  • Cytochrome P450 142 (CYP142)
  • Cytochrome P450 144 (CYP144)
  • Cytochrome P450 17A1
  • Cytochrome P450 19A1
  • Cytochrome P450 1A
  • Cytochrome P450 24A1
  • Cytochrome P450 27B1
  • Cytochrome P450 2C19
  • Cytochrome P450 2C8
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Cytochrome P450 3A5 (CYP3A5)
  • Heme oxygenase 1
  • Heme oxygenase 2
  • P-glycoprotein 1
  • Phylloquinone omega-hydroxylase CYP4F2
  • Sterol 14-alpha demethylase (CYP51)
  • Uridine-5'-diphosphoglucuronosyltransferase 1A1
  • 1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one
  • 24F2-1,25(OH)D3
  • CHEMBL75
  • KTZ
  • Ketoconazole
  • Ketoconazole (k)
  • US9138393, Ketoconozole
  • US9144538, Ketoconozole