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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
174 176 178 179 183 184 186 188 189 190 191 192 193 196 198 199 200 203 204
205 206 207 208 209 210 216 220 224 226 227 229 232 237 238 241 243 248 252
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
521 525 543 549 551 554 591 606 663 691 708 796 804 821 825 833 842 847 854
855 861 873 879 883 887 913 914 925 926 938 947 1010 1027 1050 1052 1081 1082
1099 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
6 Ki 64 IC50 4 EC50
0 ΔG°
  • 72 kDa type IV collagenase
  • Bile salt export pump
  • Butyrophilin subfamily 3 member A1
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Carbonic Anhydrase XIV
  • Carbonic anhydrase 1
  • Carbonic anhydrase 12
  • Carbonic anhydrase 2
  • Carbonic anhydrase 9
  • Farnesyl Diphosphate Synthase (FPPS)
  • Farnesyl diphosphate synthase
  • Farnesyl pyrophosphate synthase
  • Geranylgeranyl Diphosphate Synthase (GGPPS)
  • Geranylgeranyl diphosphate synthase (GGPPS)
  • Geranylgeranyl diphosphate synthase mutant (GGPPS Y107A/F108A)
  • Matrix metalloproteinase-14 (MMP14)
  • Multidrug resistance-associated protein 4
  • Octaprenyl diphosphate synthase (OPPS)
  • Putative farnesyl pyrophosphate synthase
  • Vacuolar-type proton translocating pyrophosphatase 1
  • 2-(imidazol-1-yl)-1-hydroxyethylidene-1,1-bisphosphonic acid
  • Bisphosphonate 3
  • CGP-42446
  • CHEMBL924
  • JMC515594 Compound 55
  • Reclast
  • ZOL
  • Zoledronate
  • Zometa
  • [1-hydroxy-2-(1H-imidazol-1-yl)-1-phosphonoethyl]phosphonic acid
  • zoledronic acid
76 Ki
  • β-Carbonic anhydrase 2 (CA 2)
  • Alpha carbonic anhydrase
  • Astrosclerin-3
  • Carbonate dehydratase
  • Carbonic Anhydrase (mtCA 1)
  • Carbonic Anhydrase (mtCA 3)
  • Carbonic Anhydrase 2 (Can2)
  • Carbonic Anhydrase III
  • Carbonic Anhydrase VA
  • Carbonic Anhydrase VB
  • Carbonic Anhydrase XIV
  • Carbonic Anhydrase XV
  • Carbonic anhydrase
  • Carbonic anhydrase 1
  • Carbonic anhydrase 12
  • Carbonic anhydrase 13 (CA XIII)
  • Carbonic anhydrase 2
  • Carbonic anhydrase 4
  • Carbonic anhydrase 6 (CA-VI)
  • Carbonic anhydrase 7
  • Carbonic anhydrase 9
  • Carbonic anhydrase, alpha family
  • Delta carbonic anhydrase
  • beta-Carbonic Anhydrase
  • 4-(1,1-dioxo-1,2-thiazinan-2-yl)benzene-1-sulfonamide
  • CHEMBL328560
  • Contravul
  • Ospolot
  • Sulthiame (SLT)
  • Sulthiame, 2
53 Ki 13 IC50 1 Kd 9 EC50
  • 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 6
  • 5-hydroxytryptamine receptor 7
  • Acetylcholinesterase
  • HTR1D
  • HTR2B
  • HTR6
  • HTR7
  • Melatonin receptor
  • Serotonin (5-HT) receptor
  • Serotonin 1 (5-HT1) receptor
  • Serotonin 1B/1D receptor
  • Serotonin 1d (5-HT1d) receptor
  • Serotonin 2 (5-HT2) receptor
  • Serotonin receptor 2a and 2b (5HT2A and 5HT2B)
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sphingosine 1-phosphate receptor 3
  • 2-(5-methoxy-1H-indol-3-yl)-N,N-dimethyl-ethanamine
  • 2-(5-methoxy-1H-indol-3-yl)-N,N-dimethylethanamine
  • 2-(5-methoxy-1H-indol-3-yl)ethyl-dimethyl-amine
  • 3-(2-DIMETHYLAMINOETHYL)-5-METHOXYINDOLE
  • CHEMBL7257
  • MLS000069438
  • Methoxydimethyltryptamines
  • SMR000059066
  • cid_1832
70 Ki 6 IC50
  • 5-HT5
  • 5-HT5B
  • 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 6
  • Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • HTR1A
  • HTR1D
  • HTR1F
  • HTR6
  • Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit
  • Serotonin (5-HT) receptor
  • Serotonin 1 (5-HT1) receptor
  • Serotonin 1B/1D receptor
  • Serotonin 2 (5-HT2) receptor
  • Serotonin 3a (5-HT3a)/3b (5-HT3b)/3c (5-HT3c)/3d (5-HT3d)/3e (5-HT3e) receptor
  • Serotonin receptor 2a and 2b (5HT2A and 5HT2B)
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sigma non-opioid intracellular receptor 1
  • 1-(3-(trifluoromethyl)phenyl)piperazine
  • 1-(3-Trifluoromethyl-phenyl)-piperazine
  • 1-(3-Trifluoromethyl-phenyl)-piperazine(TFMPP)
  • CHEMBL274866
  • TFMPP
76 IC50
  • Amine oxidase (flavin-containing) A
  • Amine oxidase [flavin-containing] B
  • Lysine-specific histone demethylase 1A
  • CHEMBL3775474
  • US10053456, 120
  • US10414761, Example 71
  • US9718814, 71
  • US9920047, 120
75 IC50 1 EC50
  • ALK tyrosine kinase receptor
  • Activin receptor type-1
  • Aurora kinase A/Targeting protein for Xklp2
  • Aurora kinase B
  • Axin-1/Glycogen synthase kinase-3 beta
  • BDNF/NT-3 growth factors receptor
  • CAMK2A
  • CaM kinase I delta
  • CaM-kinase kinase beta
  • Casein kinase I isoform alpha
  • Cyclin-dependent kinase 2
  • Cyclin-dependent kinase 7
  • Cyclin-dependent kinase 8
  • Cyclin-dependent kinase 9
  • Death-associated protein kinase 3
  • Dual specificity mitogen-activated protein kinase kinase 1/Mitogen-activated protein kinase 1/RAF proto-oncogene serine/threonine-protein kinase
  • Dual specificity mitogen-activated protein kinase kinase 3
  • Dual specificity mitogen-activated protein kinase kinase; MEK1/2
  • Dual specificity protein kinase CLK2
  • Dual specificity tyrosine-phosphorylation-regulated kinase 1B
  • Dual-specificity tyrosine-phosphorylation regulated kinase 1A
  • Epidermal growth factor receptor
  • Epithelial discoidin domain-containing receptor 1
  • Fibroblast growth factor receptor 1
  • Focal adhesion kinase 1
  • G protein-coupled receptor kinase 5
  • Glycogen synthase kinase-3
  • Hepatocyte growth factor receptor
  • Hepatocyte growth factor-like protein
  • High affinity nerve growth factor receptor
  • Inhibitor of nuclear factor kappa-B kinase subunit epsilon
  • Insulin receptor
  • Insulin-like growth factor I receptor
  • Leukocyte tyrosine kinase receptor
  • Macrophage colony-stimulating factor 1 receptor (CSF1R)
  • Mitogen-activated protein kinase 8
  • Mitogen-activated protein kinase 9
  • Mitogen-activated protein kinase kinase kinase 10
  • Mitogen-activated protein kinase kinase kinase kinase 2
  • Mitogen-activated protein kinase kinase kinase kinase 4
  • NT-3 growth factor receptor
  • Platelet-derived growth factor receptor alpha
  • Platelet-derived growth factor receptor beta
  • Protein kinase C iota type/zeta type
  • Protein kinase C theta type
  • Protein kinase C, PKC; classical/novel
  • Proto-oncogene tyrosine-protein kinase Src
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • RAC-alpha serine/threonine-protein kinase
  • Rho-associated protein kinase 1
  • Rho-associated protein kinase 2
  • Ribosomal protein S6 kinase alpha-1/alpha-3
  • Serine/threonine-protein kinase 16
  • Serine/threonine-protein kinase B-raf
  • Serine/threonine-protein kinase NEK2
  • Serine/threonine-protein kinase PAK 4
  • Serine/threonine-protein kinase Sgk1
  • Serine/threonine-protein kinase TAO2
  • Serine/threonine-protein kinase TBK1
  • Serine/threonine-protein kinase WEE1
  • Serine/threonine-protein kinase pim-1
  • Serine/threonine-protein kinase pim-2
  • Tyrosine kinase non-receptor protein 2
  • Tyrosine-protein kinase ABL1
  • Tyrosine-protein kinase BTK
  • Tyrosine-protein kinase Fyn
  • Tyrosine-protein kinase JAK2
  • Tyrosine-protein kinase JAK3
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase SYK
  • Tyrosine-protein kinase receptor TYRO3
  • Vascular endothelial growth factor receptor 1
  • Vascular endothelial growth factor receptor 2
  • cGMP-dependent protein kinase 1 beta
  • CHEMBL4069365
20 Ki 37 IC50 19 Kd
  • ATPase family AAA domain-containing protein 2
  • Bromodomain and extra-terminal motif (BET)
  • Bromodomain-containing protein 2
  • Bromodomain-containing protein 3
  • Bromodomain-containing protein 4
  • CREB-binding protein
  • CHEMBL1232461
55 Ki 6 IC50 15 EC50
  • Cannabinoid receptor
  • Cannabinoid receptor 1
  • Cannabinoid receptor 2
  • D(3) dopamine receptor
  • G-protein coupled receptor 55
  • Glycine receptor subunit alpha-1
  • Liver fatty acid binding protein (FABP1)
  • N-arachidonyl glycine receptor
  • Nuclear receptor subfamily 1 group I member 2
  • Transient receptor potential cation channel subfamily A member 1
  • (10R,10aR)-6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol
  • (S)-6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol
  • 1N-[2-(5-dimethylaminomethyl-2-furylmethylsulfanyl)ethyl]-1N-methyl-2-nitro-(Z)-1-ethene-1,1-diamine
  • 6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol
  • 6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol(DeltaE-9-THC)
  • 6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol(delta9-THC(delta9-tetrahydrocannabinol))
  • 8,8-Dimethyl-11-methylene-5-pentyl-3,4,8a,9,10,11,12,12a-octahydro-2H,8H-1,7-dioxa-benzo[c]phenanthrene
  • 9-Tetrahydrocannabinol
  • BDBM50007391
  • CHEMBL465
  • DRONABINOL
  • Marinol
  • Tetrahydrocannabinol
  • US9416103, Δ9-THC
  • delta-9-THC
  • delta-9-Tetrahydrocannabinol
  • delta-9-Tetrahydrocannabinol (THC)
  • delta9-THC
  • delta9-tetrahydrocannabinol
76 Ki
  • SSTR2
  • SSTR3
  • SSTR4
  • SSTR5
  • Somatostatin receptor type 1
  • Somatostatin receptor type 2
  • Somatostatin receptor type 3
  • Somatostatin receptor type 4
  • Somatostatin receptor type 5
  • BIM 23052
  • CAS_133073-82-2
19 Ki 47 IC50 10 Kd
  • AGTR1
  • Angiotensin II AT1B
  • Angiotensin II AT2
  • Angiotensin II receptor
  • Angiotensin II receptor (AT-1) type-1
  • Angiotensin II type 1a (AT-1a) receptor
  • Angiotensin IV
  • Angiotensin type II receptor
  • Angiotensin-converting enzyme
  • Bile salt export pump
  • Multidrug and toxin extrusion protein 1
  • Neprilysin
  • Phosphodiesterase 3
  • Phosphodiesterase 4
  • Platelet glycoprotein VI
  • Solute carrier organic anion transporter family member 1B1 (OATP1B1)
  • Solute carrier organic anion transporter family member 1B3 (OATP1B3)
  • Type-1A angiotensin II receptor
  • CAS_114798-26-4
  • Losartan
  • NSC_3961
76 Ki
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1D
  • 5-hydroxytryptamine receptor 3A
  • 5-hydroxytryptamine receptor 5A
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Adrenergic alpha1B
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor
  • D(1A) dopamine receptor
  • D(1B) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Dopamine receptor
  • Gamma-aminobutyric acid receptor subunit alpha-1
  • Glutamate receptor ionotropic, NMDA 1
  • Histamine H1 receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Muscarinic acetylcholine receptor M5
  • OPRD1
  • SLC6A3
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • Vasopressin V1b receptor
  • Vasopressin V2 receptor
  • CAS_5318390
  • CAS_97331
  • Hyperoside
  • Miquelianin
  • NSC_5318390
  • NSC_97331