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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   108   109   110   111   112   113   114   115   116   117   118   119   120   121   123   124   125   126   127   128   
129   130   131   132   133   134   135   137   138   139   140   142   143   144   146   148   150   152   153   154   155   
157   158   159   160   161   162   163   164   166   168   171   173   174   177   178   182   183   185   186   188   189   
190   191   194   198   199   202   203   204   207   209   213   217   221   223   224   232   233   237   238   239   241   
249   251   253   262   271   273   277   282   285   286   292   295   303   305   307   308   320   325   330   333   335   
336   337   338   344   349   360   370   378   389   397   413   425   430   435   442   443   444   445   446   447   448   
450   453   456   457   458   460   461   463   465   466   467   468   471   472   475   479   480   482   498   512   513   
521   530   535   541   558   593   622   637   644   793   804   821   825   831   834   841   848   851   852   854   856   
868   883   887   892   913   923   924   938   939   994   999   1011   1013   1027   1031   1047   1070   1072   1099   1125   1196   
1484   1506   1618   1796   
Compounds Sorted Alphabetically
Compound Name
(alphabetical)
Enz. Inhib. DataITC DataBinding TargetsAlternate Compound Names
KiIC50KdEC50KoffKonOther
BDBM12576
PNG
635000000
  • (E)-1-hydroxy-2-methyl-but-2-enyl 4-diphosphate reductase (IspH)
  • Farnesyl Diphosphate Synthase (FPPS)
  • Farnesyl diphosphate synthase
  • Farnesyl pyrophosphate synthase
  • Geranylgeranyl Diphosphate Synthase (GGPPS)
  • Hexokinase
  • Putative farnesyl pyrophosphate synthase
  • Vacuolar-type proton translocating pyrophosphatase 1
  • Bisphosphonate 1
  • CHEMBL923
  • JMC515594 Compound 64
  • RIS
  • Risdronate
  • [1-hydroxy-1-phosphono-2-(pyridin-3-yl)ethyl]phosphonic acid
BDBM14754
PNG
635020000
  • 3',5'-cyclic phosphodiesterase
  • Acetylcholinesterase
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cholinesterases
  • DNA recombination protein RecA
  • Homo sapiens phosphodiesterase 2A (PDE2A)
  • Multidrug resistance-associated protein 4
  • Phosphodiesterase (TcrPDEC)
  • Phosphodiesterase 1
  • Phosphodiesterase 3 (PDE3)
  • Phosphodiesterase 3A
  • Phosphodiesterase 4A
  • Phosphodiesterase Type 10 (PDE10A)
  • Potassium voltage-gated channel subfamily H member 2
  • Reverse transcriptase
  • cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4B
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4C
  • cGMP-inhibited 3',5'-cyclic phosphodiesterase B
  • cGMP-specific 3',5'-cyclic phosphodiesterase
  • protein-arginine deiminase type-4
  • 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline
  • 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline
  • 6,7-dimethoxy-1-veratryl-isoquinoline;hydrochloride
  • CHEMBL19224
  • Papaverine
BDBM14774
PNG
439000000
  • 3',5'-cyclic phosphodiesterase
  • Adenosine receptor A1
  • Adenosine receptor A2a
  • Adenosine receptor A2b
  • Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B
  • Class I phosphodiesterase B1 (TbrPDEB1)
  • Phosphodiesterase 4
  • Phosphodiesterase 8
  • Phosphodiesterase Type 10 (PDE10A)
  • Phosphodiesterase Type 11 (PDE11A)
  • Phosphodiesterase Type 2 (PDE2A)
  • Phosphodiesterase Type 3 (PDE3B)
  • Phosphodiesterase Type 4 (PDE4B)
  • Phosphodiesterase Type 4 (PDE4D)
  • Phosphodiesterase Type 5 (PDE5A)
  • Phosphodiesterase Type 7 (PDE7B)
  • Phosphodiesterase Type 9 (PDE9A)
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4A
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4B
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4D
  • 3-(cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)benzamide
  • CHEMBL193240
  • DAXAS
  • ROF
  • Roflumilast
BDBM26197
PNG
2517100000
  • 5-lipoxygenase/FLAP
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Carbonic Anhydrase III
  • Carbonic Anhydrase VA
  • Carbonic Anhydrase VB
  • Carbonic Anhydrase XIII
  • Carbonic Anhydrase XIV
  • Carbonic anhydrase 1
  • Carbonic anhydrase 12
  • Carbonic anhydrase 15
  • Carbonic anhydrase 2
  • Carbonic anhydrase 4
  • Carbonic anhydrase 6 (CA-VI)
  • Carbonic anhydrase 7
  • Carbonic anhydrase 9
  • Cyclooxygenase
  • Cyclooxygenase-1 (COX-1)
  • Cytochrome P450 1A
  • Cytochrome P450 1A1
  • Cytochrome P450 2J2
  • Dipeptidyl peptidase 3
  • Fatty-acid amide hydrolase 1
  • Multidrug resistance-associated protein 4
  • Myoglobin
  • Solute carrier family 22 member 6
  • CHEMBL112
  • N-(4-hydroxyphenyl)acetamide
  • Norco
  • Paracetamol
  • US9333197, Acetaminophen
  • acetaminophen
  • phenol derivative, 11
BDBM50035057
PNG
420100000
  • 5-HT3A Serotonin Receptor
  • 5-hydroxytryptamine receptor 2A
  • Adrenergic receptor beta
  • Alpha-1A adrenergic receptor
  • Benzodiazepine central
  • Beta-1 adrenergic recepto
  • CCKBR
  • Calcium channel (DHP)
  • Calcium release-activated calcium channel
  • Cysteinyl leukotriene receptor 1
  • DOPAMINE
  • Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
  • Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)
  • Glycine
  • HTR1D
  • HTR2C
  • Histamine H1 receptor
  • Ionotropic glutamate receptor NMDA 1/2D
  • Kappa-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Nociceptin/mu opioid receptor
  • Opioid receptors; mu & delta
  • Serotonin (5-HT) receptor
  • Serotonin 1 (5-HT1) receptor
  • Serotonin 1B/1D receptor
  • Sigma non-opioid intracellular receptor 1
  • Substance K
  • TRH
  • adrenergic Alpha2
  • (eltoprazine)1-(2,3-Dihydro-benzo[1,4]dioxin-5-yl)-piperazine
  • 1-(2,3-Dihydro-benzo[1,4]dioxin-5-yl)-piperazine
  • CHEMBL282614
  • Eltoprazine
BDBM50084959
PNG
394000000
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1B
  • 5-hydroxytryptamine receptor 1D
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 4 (5-HT4)
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • ADRA2B
  • Alpha adrenergic receptor 1A and 1B
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Beta-1 adrenergic recepto
  • Beta-2 adrenergic receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Histamine H1 receptor
  • Histamine H2 receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Serotonin (5-HT) receptor
  • Serotonin 1B/1D receptor
  • Serotonin 4 (5-HT4) receptor
  • Sodium-dependent serotonin transporter
  • 11'-Methyl-5-[[2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]carbonyl]-2,3,6,7-tetrahydrospiro[furo-[2,3-f]indole-3,4'-piperidine](SB-224289)
  • 4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]phenyl-1'-methylspiro[3,5,6,7-tetrahydro-2H-furo[2,3-f]indole-3,4'-(hexahydropyridine)]-5-ylmethanone
  • CHEMBL281350
  • SB-224289
  • [2'-Methyl-4'-(5-methyl-[1,2,4]oxadiazol-3-yl)-biphenyl-4-yl]-[3-(1-methyl-piperidine)-2,3,6,7-tetrahydro-1-oxa-5-aza-s-indacen-5-yl]-methanone
BDBM50099491
PNG
155310000
  • Bile acid receptor
  • Homo sapiens huntingtin (HTT), mRNA
  • Intestinal fatty acid-binding protein (hIFABP)
  • Peroxisome proliferator-activated receptor
  • Peroxisome proliferator-activated receptor alpha
  • Peroxisome proliferator-activated receptor alpha (PPAR alpha)
  • Peroxisome proliferator-activated receptor delta
  • Peroxisome proliferator-activated receptor gamma
  • Pre-mRNA-processing factor 19
  • Ubiquitin carboxyl-terminal hydrolase 1
  • Ubiquitin carboxyl-terminal hydrolase 1/WD repeat-containing protein 48
  • 2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)ethyl)phenylthio)-2-methylpropanoic acid
  • 2-(4-{2-[3-Cyclohexyl-1-(4-cyclohexyl-butyl)-ureido]-ethyl}-phenylsulfanyl)-2-methyl-propionic acid
  • CHEMBL21241
  • GW7647
  • cid_3392731
BDBM50148852
PNG
3210100000
  • 1,3-beta-glucan synthase component GLS2
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • Beta-2 adrenergic receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • Histamine H2 receptor
  • Muscarinic acetylcholine receptor M1/M5 chimeric protein
  • Sodium-dependent serotonin transporter
  • CHEMBL3769968
BDBM50254790
PNG
375010000
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • CHRM5
  • D(2) dopamine receptor
  • Histamine H1 receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Norepinephrine transporter
  • Potassium voltage-gated channel subfamily C member 1
  • Potassium voltage-gated channel subfamily H member 2
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • Twik-RElated Potassium (K+) channel 1 (TREK1)
  • (S)-Norfluoxetine
  • CHEMBL465123
  • NORFLUOXETINE
BDBM50327861
PNG
430000000
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1B
  • 5-hydroxytryptamine receptor 1D
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 3A
  • 5-hydroxytryptamine receptor 4 (5-HT4)
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Adrenergic alpha1B
  • Adrenergic receptor beta
  • Alpha-1A adrenergic receptor
  • Alpha-1D adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • DOPAMINE
  • Delta-type opioid receptor
  • Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
  • Dopamine D5 receptor
  • Dopamine receptor
  • HRH3
  • HTR4
  • Histamine H1 receptor
  • Histamine H2 receptor
  • Histamine H4 receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M1/M5 chimeric protein
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Serotonin (5-HT) receptor
  • Sigma non-opioid intracellular receptor 1
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • (1-Butylpiperidin-4-yl)methyl 4-Amino-3-methoxybenzoate
  • CHEMBL1258452
BDBM50338982
PNG
434140000
  • ATP-binding cassette sub-family G member 2
  • Adrenergic Alpha
  • Bile salt export pump (BSEP)
  • Chloroquine resistance transporter
  • Cytochrome P450 3A
  • Multidrug resistance protein 1/Multidrug resistance associated protein 1
  • Multidrug resistance-associated protein 2 (MRP2)
  • P-glycoprotein 1
  • Serum albumin
  • (R)-5-((3,4-dimethoxyphenethyl)(methyl)amino)-2-(3,4-dimethoxyphenyl)-2-isopropylpentanenitrile
  • (S)-2-(3,4-Dimethoxy-phenyl)-5-{[2-(3,4-dimethoxy-phenyl)-ethyl]-methyl-amino}-2-isopropyl-pentanenitrile
  • (S)-2-(3,4-Dimethoxy-phenyl)-5-{[2-(3,4-dimethoxy-phenyl)-ethyl]-methyl-amino}-2-isopropyl-pentanenitrile; hydrochloride
  • (S)-5-((3,4-dimethoxyphenethyl)(methyl)amino)-2-(3,4-dimethoxyphenyl)-2-isopropylpentanenitrile
  • (Verapamil) 2-(3,4-Dimethoxy-phenyl)-5-{[2-(3,4-dimethoxy-phenyl)-ethyl]-methyl-amino}-2-isopropyl-pentanenitrile
  • 2-(3,4-Dimethoxy-phenyl)-5-{[2-(3,4-dimethoxy-phenyl)-ethyl]-isopropyl-amino}-2-methyl-pentanenitrile(Verapamil)
  • 2-(3,4-dimethoxy-phenyl)-5-{[2-(3,4-dimethoxy-phenyl)-ethyl]-methyl-amino}-2-isopropyl-pentanenitrile
  • 4-[3,4-dimethoxyphenethyl(methyl)amino]-1-(3,4-dimethoxyphenyl)-1-isopropylbutyl cyanide
  • 5-((3,4-dimethoxyphenethyl)(methyl)amino)-2-(3,4-dimethoxyphenyl)-2-isopropylpentanenitrile
  • 5-{[2-(3,4-Dimethoxy-phenyl)-ethyl]-methyl-amino}-2-isopropyl-2-(3,4,5-trimethoxy-phenyl)-pentanenitrile
  • 5-{[2-(3,4-Dimethoxy-phenyl)-ethyl]-methyl-amino}-2-isopropyl-2-(4-methoxy-phenyl)-pentanenitrile
  • CP-16533-1
  • Calan
  • Calan SR
  • Covera-HS
  • D-365
  • Iproveratril
  • Isoptin
  • Isoptin SR
  • Tarka
  • VERAPAMIL
  • Verapamil;2-(3,4-Dimethoxy-phenyl)-5-{[2-(3,4-dimethoxy-phenyl)-ethyl]-methyl-amino}-2-isopropyl-pentanenitrile
  • Verapramil
  • Verelan
  • verapamil-R
BDBM50344942
PNG
627190000
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Chitinase B
  • Cytochrome P450 1B1
  • Cytochrome P450 2J2
  • Cytochrome P450 3A
  • Low molecular weight phosphotyrosine protein phosphatase (LMWPTP)
  • Motilin receptor
  • Multidrug and toxin extrusion protein 1
  • Multidrug resistance-associated protein 4
  • Organic anion-transporting polypeptide 1D1 (Oatp1d1)
  • P-glycoprotein (P-gp)
  • P-glycoprotein 1
  • P-glycoprotein 1 and 3 (MDR1a/MDR1b)
  • Potassium voltage-gated channel subfamily H member 2
  • Serum albumin
  • Sterol 14α-demethylase (CYP51)
  • CHEMBL532
  • E-MYCIN E
  • ERYTHROMYCIN
  • ERYTHROMYCIN ETHYLSUCCINATE
  • Erycette
  • Erymax
  • Erythromycin A
  • Erythromycin C
  • Ilotycin
  • T-Stat
BDBM50366567
PNG
931300000
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cytochrome P450 2D6 (2D6)
  • Krueppel-like factor 10
  • Multidrug resistance-associated protein 4
  • Norepinephrine Monoamine transporters
  • Potassium voltage-gated channel subfamily H member 2
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • Transporter
  • ATOMOXETINE
BDBM50367247
PNG
1130110000
  • Adrenaline alpha1
  • Adrenaline alpha2
  • Adrenergic Alpha
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cystic fibrosis transmembrane conductance regulator
  • Cytochrome P450 2D1
  • Cytochrome P450 2D18
  • Cytochrome P450 2D2
  • Cytochrome P450 2D3
  • Cytochrome P450 2D6 (2D6)
  • Histidine-rich protein
  • Multidrug resistance-associated protein 4
  • P-glycoprotein 1
  • Serum albumin
  • Sodium channel protein type I I alpha subunit
  • Solute carrier family 22 member 1
  • Solute carrier family 22 member 2
  • Solute carrier organic anion transporter family member 1A1
  • Solute carrier organic anion transporter family member 1A4
  • Twik-RElated Potassium (K+) channel 1 (TREK1)
  • QUININE
  • Quinamm
  • Quinsan
  • cid_3034034
BDBM50449038
PNG
430000000
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Delta-type opioid receptor
  • Histamine H1 receptor
  • Histamine H2 receptor
  • Histamine H3 receptor
  • Histamine H4 receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • Nitric Oxide Synthase, endothelial
  • Nitric Oxide Synthase, inducible
  • Nitric oxide synthase, brain
  • Nitric oxide synthase, endothelial
  • Nitric oxide synthase, inducible
  • Nitric-oxide synthase (endothelial and brain)
  • Nitric-oxide synthase, brain
  • Nitric-oxide synthase, endothelial
  • Nociceptin receptor
  • Serotonin (5-HT) receptor
  • Serotonin 3 (5-HT3) receptor
  • CHEMBL3126204
  • US9212144, 15 (Ex. 17)
BDBM50453949
PNG
024010000
  • ATPase family AAA domain-containing protein 2
  • ATPase family AAA domain-containing protein 2B
  • Bromodomain adjacent to zinc finger domain protein 2A
  • Bromodomain adjacent to zinc finger domain protein 2B
  • Bromodomain and PHD finger-containing protein 3
  • Bromodomain and WD repeat-containing protein 1
  • Bromodomain testis-specific protein
  • Bromodomain-containing protein 1
  • Bromodomain-containing protein 2
  • Bromodomain-containing protein 3
  • Bromodomain-containing protein 4
  • Bromodomain-containing protein 7
  • Bromodomain-containing protein 8
  • Bromodomain-containing protein 9
  • CREB-binding protein
  • CREB-binding protein/Histone acetyltransferase p300
  • Cat eye syndrome critical region protein 2
  • E3 ubiquitin-protein ligase TRIM33
  • HIF1A/p300/CREB-binding protein
  • Histone acetyltransferase KAT2A/KAT2B
  • Nucleosome-remodeling factor subunit BPTF
  • Peregrin
  • Probable global transcription activator SNF2L2
  • Protein polybromo-1
  • Transcription activator BRG1
  • Transcription initiation factor TFIID subunit 1
  • Transcription initiation factor TFIID subunit 1-like
  • Transcription intermediary factor 1-alpha
  • CHEMBL4208820