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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
BDBM10318
PNG
918010000
  • Caspase-1
  • Caspase-2
  • Caspase-3
  • Caspase-4
  • Caspase-6
  • Caspase-7
  • Caspase-8
  • Caspase-9
  • (S)-5-{1-[2-(Phenoxymethyl)pyrrolidinyl]sulfonyl}isatin
  • 5-{[(2S)-2-(phenoxymethyl)pyrrolidine-1-]sulfonyl}-2,3-dihydro-1H-indole-2,3-dione
  • CHEMBL62993
  • Isatin Sulfonamide 29
  • Pyrrolidine Isatin Analogue 10
BDBM10758
PNG
1131130000
  • 5-hydroxytryptamine receptor 2A
  • Alpha-1A adrenergic receptor
  • Cytochrome P450 2A5
  • Cytochrome P450 2A6
  • Lysyl oxidase homolog 2
  • Phenylethanolamine N-methyltransferase
  • Thrombin & trypsin
  • Trace amine-associated receptor 1
  • Trace amine-associated receptor 1 (TAAR1)
  • Trypsin-1
  • trace amine-associated receptor 1
  • 14C-phenylethylamine
  • 2-phenylethan-1-amine
  • CHEMBL610
  • phenylethylamine
BDBM11641
PNG
280000000
  • Carbonic Anhydrase III
  • Carbonic Anhydrase IV
  • Carbonic Anhydrase VA
  • Carbonic Anhydrase VB
  • Carbonic Anhydrase XIV
  • Carbonic anhydrase
  • Carbonic anhydrase 1
  • Carbonic anhydrase 12
  • Carbonic anhydrase 13 (CA XIII)
  • Carbonic anhydrase 15
  • Carbonic anhydrase 2
  • Carbonic anhydrase 4
  • Carbonic anhydrase 6 (CA-VI)
  • Carbonic anhydrase 7
  • Carbonic anhydrase 9
  • Carbonic anhydrases; II & IX
  • 1-N-(4-sulfamoylphenyl-ethyl)-2,4,6-trimethylpyridiniumperchlorate
  • 2,4,6-trimethyl-1-[2-(4-sulfamoylphenyl)ethyl]pyridin-1-ium perchlorate
  • CHEMBL352535
  • Compound 10
  • pyridinium deriv. 10
BDBM14769
PNG
028000000
  • Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B
  • Phosphodiesterase (TcrPDEC)
  • Phosphodiesterase 1
  • Phosphodiesterase 2A
  • Phosphodiesterase 3
  • Phosphodiesterase 3 (PDE3)
  • 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 4B
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4D
  • cGMP-specific 3',5'-cyclic phosphodiesterase
  • 6-(3,4-Dimethoxy-phenyl)-4,5-dimethyl-4,5-dihydro-2H-pyridazin-3-one
  • 6-(4-(difluoromethoxy)-3-methoxyphenyl)pyridazin-3(2H)-one
  • 6-(4-Difluoromethoxy-3-methoxy-phenyl)-2H-pyridazin-3-one
  • 6-[4-(difluoromethoxy)-3-methoxyphenyl]-2,3-dihydropyridazin-3-one
  • CHEMBL313842
  • Zaradaverine
  • Zardaverine
BDBM17283
PNG
1810000000
  • Coagulation factor X
  • Plasminogen
  • Thrombin and coagulation factor X
  • Tissue-type plasminogen activator
  • Trypsin
  • Trypsin-1
  • (2S)-3-(7-carbamimidoylnaphthalen-2-yl)-2-(4-{[(3S)-1-ethanimidoylpyrrolidin-3-yl]oxy}phenyl)propanoic acid
  • CHEMBL19902
  • DX-9065a
BDBM18358
PNG
721000000
  • α-galactosidase
  • α-glucosidase
  • β-galactosidase
  • Beta-galactosidase
  • Beta-glucosidase
  • Ceramide glucosyltransferase
  • Lysosomal acid glucosylceramidase
  • Probable alpha-glucosidase Os06g0675700
  • Sucrase-isomaltase
  • alpha-Glucosidase (alpha-Glu)
  • alpha-glucosidase (Gaa)
  • (2R,3R,4R,5S)-2-(hydroxymethyl)-1-nonylpiperidine-3,4,5-triol
  • N-Nonyl-DNJ
BDBM19855
PNG
815050000
  • Cathepsin (B and K)
  • Cathepsin D
  • Cathepsin K
  • Cathepsin L1
  • Cathepsin S
  • Balicatib
  • CHEMBL371064
  • N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-(4-propylpiperazin-1-yl)
  • N-{1-[(cyanomethyl)carbamoyl]cyclohexyl}-4-(4-propylpiperazin-1-yl)benzamide
  • basic piperazine-containing compound, 10
BDBM19856
PNG
419050000
  • Cathepsin (B and K)
  • Cathepsin K
  • Cathepsin L1
  • Cathepsin S
  • (2R)-N-(cyanomethyl)-4-methyl-2-{3-[4-(piperazin-1-yl)phenyl]phenyl}pentanamide
  • CHEMBL184514
  • JMC463709 (R)-2
  • piperazine-containing compound, 11
BDBM22889
PNG
1018000000
  • Adrenergic Alpha
  • Aldehyde oxidase
  • Cytochrome P450 3A
  • HRH3
  • Histamine H1 receptor
  • Histamine H2 receptor
  • Histamine H3 receptor
  • Histamine H4 receptor
  • 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)
  • Potassium-transporting ATPase alpha chain 1/beta chain
  • Solute carrier family 22 member 11
  • Solute carrier family 22 member 2
  • Solute carrier family 22 member 6
  • Solute carrier family 22 member 8
  • (Cimetidine) N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-guanidine,cyanide
  • (Cimetidine)N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]cyanomethyliminomethanediamine
  • (cimetidine) N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]cyanoiminomethanediamine
  • 1-cyano-2-methyl-3-(2-((5-methyl-1H-imidazol-4-yl)methylthio)ethyl)guanidine
  • 1-cyano-2-methyl-3-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine
  • 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)-benzenesulfonamide(Cimetidine)
  • 2-Methyl-8-phenethyl-imidazo[1,2-a]pyridine-3-carboxylic acid methyl ester(cimetidine)
  • 2-methylamino-2-[2-(4-methyl-1H-5-imidazolylmethylsulfanyl)ethylamino]-(E)-1-imino cyanide
  • 2-methylamino-2-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethylamino]-(Z)-1-imino cyanide(cimetidine)
  • ; N''''''''-cyano-N-methyl-N''''-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)-ethyl)guanidine
  • CHEMBL30
  • CIMETIDINE
  • Cimetidine
  • Eureceptor
  • N''''''''''''''''-cyano-N-methyl-N''''''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine
  • N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]-lambda~4~-sulfanyl}ethyl)guanidine
  • N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine
  • N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine (Cimetidine)
  • N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine(cimetidine)
  • N''''''''-cyano-N-methyl-N''''-({[(5-methyl-1H-imidazol-4-yl)methyl]thio}methyl)guanidine(cimetidine)
  • N-Cyano-N''''-methyl-N''''''''-(2-(((5-methyl-1H-imidazol-4-yl) methyl)thio)ethyl)guanidine(Cimetidine)
  • N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-N''''''''-Cyano-guanidine
  • N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-N''''''''-cyano-guanidine(Cimetidine)
  • N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-cyanoguanidine(cimetidine)
  • N-cyanomethyl-N''''-methyl-N''''''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-guanidine ( Cimetidine)
  • N-methyl-N''''-cyano-N''''''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-guanidine
  • N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]-1-cyanoiminomethanediamine
  • N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]cyanoiminomethanediamine (cimetidine)
  • N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]imino(-N-cyano)methanediaminem
  • N-tert-Butyl-N''''-[4-(1H-imidazol-4-yl)-phenyl]-formamidine(cimetidine)
  • Tagamet
  • Tagamet HB
  • Tagamet hb 200
  • cemitidine
BDBM23183
PNG
194230000
  • Adenosine receptor A3
  • D-Amino Acid Oxidase (DAAO)
  • Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
  • GABA A Alpha2Beta1Gamma2
  • GABA A receptor alpha-1/beta-1/gamma-2
  • GABA A receptor alpha-3/beta-2/gamma-2
  • GABA A receptor alpha-6/beta-2/gamma-2
  • GABA B rho 1
  • GABA receptor gamma-1 subunit
  • GABA receptor rho-2 subunit
  • GABA transporter
  • GABA-C receptor
  • Gamma-aminobutyric acid receptor subunit alpha-5 (GABA(A))
  • Gamma-aminobutyric acid type B receptor subunit 1
  • 5-(aminomethyl)-1,2-oxazol-3-ol
  • Agarin
  • CHEMBL273481
  • Muscimol
  • Pantherine
BDBM249482
PNG
028000000
  • Retinol-binding protein 4
  • Transthyretin
  • spa binding assay for rbp4
  • US10072016, Compound 81
  • US10407433, Compound 81
  • US9434727, 80
  • US9434727, 81
  • US9777010, Compound 81
BDBM292107
PNG
280000000
  • JAK1/TYK2
  • Non-receptor tyrosine-protein kinase TYK2
  • Tyrosine-protein kinase JAK1
  • Tyrosine-protein kinase JAK2
  • Tyrosine-protein kinase JAK3
  • US10100049, Example 4
  • US10183942, Example 4-2
  • US10526330, Example 4
BDBM292112
PNG
280000000
  • JAK1/TYK2
  • Non-receptor tyrosine-protein kinase TYK2
  • Tyrosine-protein kinase JAK1
  • Tyrosine-protein kinase JAK2
  • Tyrosine-protein kinase JAK3
  • US10100049, Example 9
  • US10183942, Example 9-2
  • US10526330, Example 9
BDBM29643
PNG
517060000
  • Apoptosis Regulator Bcl-xL
  • Apoptosis regulator Bcl-2
  • BCL-W
  • Bcl-2-related protein A1
  • Cathepsin L1
  • D(2) dopamine receptor
  • D(4) dopamine receptor
  • DOPAMINE
  • Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
  • Dopamine receptor
  • Glucose 6-phosphate dehydrogenase (G6PD)
  • Induced myeloid leukemia cell differentiation protein Mcl-1
  • M18 aspartyl aminopeptidase
  • MDM2-MDMX
  • MPI protein
  • Runt-Related Transcription Factor 1 Isoform AML1C
  • eukaryotic translation initiation factor 4 gamma, 1 isoform 4
  • glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase
  • glutathione S-transferase
  • poly(A) binding protein, cytoplasmic 1
  • (6aS)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrochloride
  • (S)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol
  • Apomorphine,(+)
  • CHEMBL416288
  • MLS000028867
  • S(+)-10,11-DIHYDROXYAPORPHINE HYDROCHLORIDE
  • SMR000058671
  • cid_6852389
BDBM31757
PNG
028000000
  • Dual Specificity Protein Phosphatase 1
  • Dual specificity phosphatase Cdc25B
  • Estradiol receptor beta (ERβ)
  • Glyceraldehyde-3-phosphate dehydrogenase liver
  • Heat Shock 70kDa Protein 1
  • Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP
  • Hematopoietic protein-tyrosine phosphatase (HEPTP)
  • MKP-3
  • NS3
  • Voltage-gated calcium channel subunit alpha Cav2.2
  • core protein
  • eukaryotic translation initiation factor 4 gamma, 1 isoform 4
  • heat shock 70kDa protein 8 isoform 2
  • lens epithelium-derived growth factor p75
  • neuronal munc18-1 binding protein
  • 6-hydroxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • 6-oxidanyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • MLS-0015717.0001
  • cid_654089
BDBM32050
PNG
0180100000
  • Apoptosis Regulator Bcl-xL
  • Apoptosis regulator Bcl-2
  • Axin-1/Glycogen synthase kinase-3 beta
  • BCL-W
  • Beta lactamase
  • Bfl-1
  • D(1A) dopamine receptor
  • Dual Specificity Protein Phosphatase 1
  • Ephrin type-B receptor 4
  • Heat shock protein HSP 90-alpha
  • LANA
  • MKP-3
  • Mitogen-activated protein kinase 10
  • Mitogen-activated protein kinase kinase kinase kinase 2
  • Serine/threonine-protein kinase 33
  • Voltage-gated calcium channel subunit alpha Cav2.2
  • beta-lactamase
  • glutathione S-transferase
  • metallo-beta-lactamase IMP-1
  • MLS000080844
  • SMR000044769
  • cid_663844
BDBM342597
PNG
1017010000
  • 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
  • CREB-binding protein
  • Cat eye syndrome critical region protein 2
  • E3 ubiquitin-protein ligase TRIM33
  • Histone acetyltransferase KAT2A/KAT2B
  • Probable global transcription activator SNF2L2
  • Protein polybromo-1
  • Transcription activator BRG1
  • Transcription initiation factor TFIID subunit 1-like
  • Transcription intermediary factor 1-alpha
  • N-[3-(3-methyl-4-oxo-4,5,6,7-tetrahydro-2H-isoindol-1-yl)-4-phenoxyphenyl]methanesulfonamide
  • US9776990, Example 40
BDBM34737
PNG
026020000
  • Caspase-3
  • Cathepsin L1
  • DNA dC->dU-editing enzyme APOBEC-3G
  • Glucose 6-phosphate dehydrogenase (G6PD)
  • M18 aspartyl aminopeptidase
  • MPI protein
  • Mannose-6-phosphate isomerase
  • Probable global transcription activator SNF2L2
  • eukaryotic translation initiation factor 4 gamma, 1 isoform 4
  • glucose-6-phosphate dehydrogenase
  • glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase
  • hexokinase
  • neutrophil cytosolic factor 1
  • phosphatase, orphan 1
  • phosphomannomutase 2
  • probable DNA dC->dU-editing enzyme APOBEC-3A
  • streptokinase A precursor
  • 2-(4-methylphenyl)-1,2-benzisothiazol-3(2H)-one
  • 2-(4-methylphenyl)-1,2-benzothiazol-3-one
  • 2-(p-tolyl)-1,2-benzothiazol-3-one
  • MLS000583746
  • SMR000200989
  • cid_935415
BDBM34966
PNG
021070000
  • DNA dC->dU-editing enzyme APOBEC-3G
  • G protein signalling regulator 19
  • Glucose 6-phosphate dehydrogenase (G6PD)
  • MPI protein
  • MSRA protein
  • Mannose-6-phosphate isomerase
  • RGS7
  • Regulator of G-protein signaling 8
  • eukaryotic translation initiation factor 4 gamma, 1 isoform 4
  • glucose-6-phosphate dehydrogenase
  • glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase
  • hexokinase
  • large T antigen
  • neutrophil cytosolic factor 1
  • phosphatase, orphan 1
  • phosphomannomutase 2
  • regulator of G-protein signaling 4
  • regulator of G-protein signalling 16
  • 3-(3-keto-1,2-benzothiazol-2-yl)-N,N-dimethyl-benzenesulfonamide
  • MLS000773738
  • N,N-dimethyl-3-(3-oxidanylidene-1,2-benzothiazol-2-yl)benzenesulfonamide
  • N,N-dimethyl-3-(3-oxo-1,2-benzothiazol-2-yl)benzenesulfonamide
  • SMR000364449
  • cid_5040456
BDBM47776
PNG
460180000
  • DNA dC->dU-editing enzyme APOBEC-3G
  • G protein signalling regulator 19
  • Glucose 6-phosphate dehydrogenase (G6PD)
  • Guanine nucleotide-binding protein G(o), alpha subunit 1
  • RGS7
  • Regulator of G-protein signaling 8
  • glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase
  • probable DNA dC->dU-editing enzyme APOBEC-3A
  • regulator of G-protein signaling 4
  • regulator of G-protein signalling 16
  • 3-chloranyl-N-(3-morpholin-4-ylpropyl)-6-nitro-1-benzothiophene-2-carboxamide
  • 3-chloro-N-(3-morpholin-4-ylpropyl)-6-nitro-1-benzothiophene-2-carboxamide
  • 3-chloro-N-(3-morpholinopropyl)-6-nitro-benzothiophene-2-carboxamide
  • 3-chloro-N-[3-(4-morpholinyl)propyl]-6-nitro-1-benzothiophene-2-carboxamide
  • MLS000684370
  • SMR000295947
  • cid_2225472
BDBM50000540
PNG
026020000
  • Arachidonate 15-lipoxygenase
  • Arachidonate 5-lipoxygenase
  • Cyclooxygenase
  • Phospholipase A2 group 1B
  • Prostaglandin G/H synthase (cyclooxygenase)
  • 1-(3-Trifluoromethyl-phenyl)-4,5-dihydro-1H-pyrazol-3-ylamine
  • 1-(3-Trifluoromethyl-phenyl)-4,5-dihydro-1H-pyrazol-3-ylamine (BW-755C)
  • 1-(3-Trifluoromethyl-phenyl)-4,5-dihydro-1H-pyrazol-3-ylamine(BW 755 C)
  • 1-(3-Trifluoromethyl-phenyl)-4,5-dihydro-1H-pyrazol-3-ylamine(BW 755C)
  • 1-(3-trifluoromethylphenyl)-4,5-dihydro-1H-3-pyrazolamine
  • BW-755C
  • CHEMBL274642
BDBM50001285
PNG
1015030000
  • Bile salt export pump
  • CYSLTR2
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cysteinyl leukotriene receptor
  • Cysteinyl leukotriene receptor 1
  • Multidrug resistance protein 1/Multidrug resistance associated protein 1
  • Multidrug resistance-associated protein 2 (MRP2)
  • Multidrug resistance-associated protein 4
  • Multidrug resistance-associated protein 5
  • (E)-3-((3-(2-(7-chloroquinolin-2-yl)vinyl)phenyl)(3-(dimethylamino)-3-oxopropylthio)methylthio)propanoic acid
  • 3-(((3-(2-(7-chloroquinoline-2-yl)ethenyl)phenyl)((3-dimethylamino-3-oxopropyl)thio)methyl)thio)propanoic acid
  • 3-((3-(2-(7-chloroquinolin-2-yl)vinyl)phenyl)(3-(dimethylamino)-3-oxopropylthio)methylthio)propanoic acid
  • 3-[{3-[(E)-2-(7-Chloro-quinolin-2-yl)-vinyl]-phenyl}-(2-diethylcarbamoyl-ethylsulfanyl)-methylsulfanyl]-propionic acid
  • 3-[{3-[(E)-2-(7-Chloro-quinolin-2-yl)-vinyl]-phenyl}-(2-dimethylcarbamoyl-ethylsulfanyl)-methylsulfanyl]-propionic acid
  • 3-[{3-[2-(7-Chloro-quinolin-2-yl)-vinyl]-phenyl}-(2-dimethylcarbamoyl-ethylsulfanyl)-methylsulfanyl]-propionic acid(MK-571)
  • 3-[{3-[2-(7-Chloro-quinolin-2-yl)-vinyl]-phenyl}-(2-dimethylcarbamoyl-ethylsulfanyl)-methylsulfanyl]-propionic acid(MK-571, L-660711)
  • CHEMBL15177
  • L-660711
  • MK 571
  • MK-571
BDBM50005120
PNG
271000000
  • 5-HT3A Serotonin Receptor
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • DRD2
  • Dopamine D2 receptor and Serotonin 2a receptor (D2 and 5HT2a)
  • Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
  • Dopamine receptor
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • CHEMBL274491
  • N-((2S,3S)-1-Benzyl-2-methyl-pyrrolidin-3-yl)-5-chloro-2-methoxy-4-methylamino-benzamide
  • N-(1-Benzyl-2-methyl-pyrrolidin-3-yl)-5-chloro-2-methoxy-4-methylamino-benzamide
  • Nemonapride
  • YM-09151-2
BDBM50007664
PNG
217000000
  • Acetylcholinesterase
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cholecystokinin receptor
  • Cholinesterase
  • GABA receptor alpha-1/beta-3/gamma-2 subunit
  • GABA receptor alpha-2/beta-3/gamma-2 subunit
  • GABA receptor alpha-3/beta-3/gamma-2 subunit
  • GABA receptor alpha-5/beta-3/gamma-2 subunit
  • Multidrug resistance-associated protein 4
  • Peripheral-Type Benzodiazepine Receptor
  • 7-chloro-2-methylamino-5-phenyl-3H-1,4-benzodiazepin-4-oxide
  • 7-chloro-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-amine 4-oxide
  • CDP
  • CHEMBL451
  • CHLORDIAZEPOXIDE
  • clopoxide
  • methaminodiazepoxide
BDBM50011780
PNG
1141300000
  • Acetylcholinesterase
  • Choline Acetyltransferase
  • Cholinesterases
  • Muscarinic acetylcholine receptor
  • 2-[(E)-(hydroxyimino)methyl]-1-methylpyridinium chloride
  • CHEMBL748
  • PRALIDOXIME
  • PRALIDOXIME CHLORIDE
  • Pralidoxine chloride
BDBM50019213
PNG
235000000
  • Cholecystokinin A receptor
  • Cholecystokinin receptor
  • GABA A Alpha2Beta1Gamma2
  • GABA A receptor alpha-1/beta-1/gamma-2
  • GABA A receptor alpha-3/beta-2/gamma-2
  • Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)
  • Gamma-aminobutyric acid type B receptor subunit 1
  • Translocator protein
  • 1,3-dihydro-7-nitro-5-(2-chlorophenyl)-2H-1,4.benzodiazepin-2-one
  • 5-(2-chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one
  • 5-(o-chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one
  • CHEMBL452
  • CLONAZEPAM
BDBM50019355
PNG
184060000
  • Adrenergic receptor alpha
  • Adrenergic receptor beta
  • Beta-1 adrenergic recepto
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor
  • Beta-2 adrenergic receptor and beta-3 adrenergic receptor
  • Beta-3 adrenergic receptor
  • Dopamine receptor
  • Prostanoid TP receptor
  • TBXA2R
  • Thromboxane A2 receptor
  • 1-(3,4,5-Trimethoxy-benzyl)-1,2,3,4-tetrahydro-isoquinoline-6,7-diol
  • 1-(3,4,5-trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
  • CHEMBL299175
  • R(+)-TMQ
  • TMQ, Racemic
  • Tretoquinol
BDBM50024206
PNG
262000000
  • 5-HT5
  • 5-HT5B
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2C
  • Acetylcholinesterase
  • HTR1F
  • HTR6
  • HTR7
  • Serotonin (5-HT) receptor
  • Serotonin 1 (5-HT1) receptor
  • Serotonin 1B/1D receptor
  • Serotonin 2 (5-HT2) receptor
  • Sodium-dependent serotonin transporter
  • 3-[2-(dimethylamino)ethyl]-1H-indol-5-ol
  • 3-[2-(dimethylamino)ethyl]-5-indolol
  • 3-[2-(dimethylamino)ethyl]indol-5-ol
  • 3-[beta-(dimethylamino)ethyl]-5-hydroxyindole
  • 5-hydroxy-N,N-dimethyltryptamine
  • Bufotenin
  • Bufotenine
  • CHEMBL416526
  • DM5-HT
  • DMT,5-OH
  • N,N-dimethylserotonin
BDBM50030623
PNG
280000000
  • ADRA2C
  • Adrenergic alpha1B
  • Adrenergic receptor alpha-2
  • Alpha-1A adrenergic receptor
  • Alpha-1D adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • adrenergic Alpha2
  • 6-Chloro-3-methyl-9-(3-methyl-but-2-enyloxy)-2,3,4,5-tetrahydro-1H-benzo[d]azepine
  • CHEMBL114166
  • SK&F-104078
  • SK-104078
  • SKF 104078
BDBM50031299
PNG
226000000
  • Bile salt export pump
  • Calcium channel (Type L)
  • Dihydrofolate reductase
  • Potassium voltage-gated channel subfamily H member 2
  • Sigma non-opioid intracellular receptor 1
  • Sodium channel protein type 10 subunit alpha
  • Sodium channel protein type 2 alpha subunit
  • Sodium channel protein type 5 subunit alpha
  • Sodium channel protein type 9 subunit alpha
  • Sodium channel protein type I I alpha subunit
  • Sodium channel protein type II alpha subunit
  • Voltage-gated potassium channel beta subunit Mink/subunit Kv7.1
  • Voltage-gated sodium channel subunit alpha Nav1.3 (Nav1.3)
  • Voltage-gated sodium channel subunit alpha Nav1.4 (Nav1.4)
  • Voltage-gated sodium channel subunit alpha Nav1.8
  • 6-(2,3-Dichloro-phenyl)-[1,2,4]triazine-3,5-diamine
  • 6-(2,3-Dichloro-phenyl)-[1,2,4]triazine-3,5-diamine(lamotrigine)
  • 6-(2,3-dichlorophenyl)-1,2,4-triazine-3,5-diamine
  • BW-430C
  • CHEMBL741
  • LAMOTRIGINE
  • Lamictal
  • Lamictal cd
BDBM50032221
PNG
062200000
  • Retinoic acid receptor RXR-alpha
  • Retinoid X receptor gamma/retinoic acid receptor alpha
  • Retinoid receptor
  • 4-[(E)-2-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-propenyl]-benzoic acid
  • CHEMBL32505
BDBM50034501
PNG
700210000
  • GRIA3
  • Glutamate kainate
  • Glutamate receptor 1 (GluA1)
  • Glutamate receptor ionotropic, AMPA 2
  • Glutamate receptor ionotropic, AMPA 4
  • Glutamate receptor ionotropic, kainate
  • Ionotropic glutamate receptor kainate 2/5
  • Metabotropic glutamate receptor
  • Metabotropic glutamate receptor 1
  • Metabotropic glutamate receptor 2
  • Metabotropic glutamate receptor 3
  • Metabotropic glutamate receptor 4 (mGlu4)
  • Metabotropic glutamate receptor 6 (mGlu6)
  • Metabotropic glutamate receptor 8
  • (S)-Amino-(3-hydroxy-isoxazol-5-yl)-acetic acid
  • (S)-Amino-(3-oxo-2,3-dihydro-isoxazol-5-yl)-acetic acid
  • CHEMBL30285
BDBM50034910
PNG
600220000
  • Melanocortin receptor 1
  • Melanocortin receptor 3
  • Melanocortin receptor 4
  • Melanocortin receptor 5 (MC5R)
  • Melanocyte-stimulating hormone receptor
  • (S)-2-{(S)-2-[(S)-2-acetylamino-3-(3H-imidazol-4-yl)-propionylamino]-3-phenyl-propionylamino}-5-guanidino-pentanoic acid [(S)-1-carbamoyl-2-(1H-indol-3-yl)-ethyl]-amide
  • 2-{2-[2-Acetylamino-3-(1H-imidazol-4-yl)-propionylamino]-3-phenyl-propionylamino}-5-guanidino-pentanoic acid [1-carbamoyl-2-(1H-indol-3-yl)-ethyl]-amideAc-His-DPhe-DArg-Trp-NH2
  • 2-{2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionylamino]-3-phenyl-propionylamino}-5-guanidino-pentanoic acid [1-carbamoyl-2-(1H-indol-3-yl)-ethyl]-amide
  • 2-{2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionylamino]-3-phenyl-propionylamino}-5-guanidino-pentanoic acid [1-carbamoyl-2-(1H-indol-3-yl)-ethyl]-amide(Ac-His-Phe-Arg-Trp-NH2)
  • Ac-His-D-Phe-Arg-D-Trp-NH2
  • Ac-His-DPhe-Arg-Trp-NH2
  • Ac-His-Phe-Arg-Trp-NH2
  • CHEMBL50056
BDBM50044657
PNG
028000000
  • Aurora kinase A/Targeting protein for Xklp2
  • Aurora kinase B
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Serine/threonine-protein kinase PLK1
  • Serine/threonine-protein kinase PLK2
  • Serine/threonine-protein kinase PLK3
  • Serine/threonine-protein kinase PLK4
  • Tyrosine-protein kinase receptor FLT3
  • Vascular endothelial growth factor receptor 2
  • CHEMBL3353347
  • US10358436, Example A24
  • US9907800, Example A24
BDBM50053929
PNG
271000000
  • Adenosine Receptors A2a (A2a)
  • Adenosine receptor A1
  • Adenosine receptor A2a
  • Adenosine receptor A2a and A3
  • Adenosine receptor A3
  • CHEMBL88147
  • N-(9-Chloro-2-furan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-2-phenyl-acetamide
  • N-(9-Chloro-2-furan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-N-methyl-2-phenyl-acetamide
  • N-(9-chloro-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-2-phenylacetamide
BDBM50056101
PNG
226000000
  • 5-hydroxytryptamine receptor 2A
  • ADRB2
  • Alpha-1A adrenergic receptor
  • CCKBR
  • Cholecystokinin receptor
  • DOPAMINE
  • Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
  • GRIA3
  • Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)
  • Histamine H1 receptor
  • Kappa-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Nociceptin/mu opioid receptor
  • Serotonin (5-HT) receptor
  • Sigma non-opioid intracellular receptor 1
  • adrenergic Alpha2
  • 1-[(R)-2-Oxo-1-(2-oxo-2-o-tolyl-ethyl)-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl]-3-m-tolyl-urea
  • CHEMBL115121
  • YM022
  • YM022 Racemate
BDBM50056401
PNG
243010000
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 3A
  • 5-hydroxytryptamine receptor 4 (5-HT4)
  • Cerebral cortex alpha adrenergic receptor
  • HTR1D
  • HTR2C
  • HTR4
  • Nociceptin/mu opioid receptor
  • Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor
  • adrenergic Alpha2
  • 2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]benzoate
  • 4-Amino-5-chloro-2-methoxy-benzoic acid 2-diethylamino-ethyl ester
  • CHEMBL287045
  • SDZ 205557
  • SDZ-205557
BDBM50060728
PNG
205210000
  • NPFF2
  • Neuropeptide FF receptor 1
  • Neuropeptide Y receptor type 1
  • Neuropeptide Y receptor type 2
  • Neuropeptide Y receptor type 5 ( NPY Y5)
  • PPYR1
  • (R)-2-(2,2-diphenylacetamido)-5-guanidino-N-(4-hydroxybenzyl)pentanamide
  • (R)-2-Diphenylacetylamino-5-guanidino-pentanoic acid 4-hydroxy-benzylamide
  • (R)-5-(diaminomethyleneamino)-2-(2,2-diphenylacetamido)-N-(4-hydroxybenzyl)pentanamide
  • CHEMBL332347
BDBM50061220
PNG
1711000000
  • CCKBR
  • Cholecystokinin B
  • Cholecystokinin B receptor
  • Cholecystokinin receptor
  • Potassium voltage-gated channel subfamily H member 2
  • 1-((S)-1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-m-tolyl-urea
  • 1-(1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-m-tolyl-urea
  • 1-(1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-m-tolyl-urea((S)L365_260)
  • CHEMBL70380
  • L-365,260
BDBM50067593
PNG
1112320000
  • Adrenaline alpha1
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • HIV-1 protease
  • Multidrug resistance-associated protein 4
  • Nuclear receptor subfamily 1 group I member 2
  • Protease
  • CHEBI:44032
  • Crixivan
  • INDINAVIR
  • Indinavir
  • L-735524
  • MK-639
BDBM50081909
PNG
217000000
  • Dihydrofolate Reductase-Thymidylate Synthase (DHFR-TS) Mutant KICB1
  • Dihydrofolate reductase
  • 5-(3-(benzyloxy)benzyl)pyrimidine-2,4-diamine
  • 5-(3-Benzyloxy-benzyl)-pyrimidine-2,4-diamine
  • CHEMBL274031
BDBM50103521
PNG
21301300
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