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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
22 IC50
  • Activin receptor type-1
  • Activin receptor type-1B
  • Activin receptor type-1B/Activin receptor-like kinase 4 (ALK-4)
  • Activin receptor-like kinase 3 (ALK-3)
  • Bone morphogenetic protein receptor type-1B (BMPR1B) aa 168-495
  • Serine/threonine-protein kinase receptor R3
  • Serine/threonine-protein kinase receptor R3 (ALK1)
  • TGF-beta receptor type-1
  • US10017516, Compound 17
  • US9682983, 1
  • US9682983, 17
22 IC50
  • Cereblon/Histone deacetylase 6
  • Histone deacetylase 1
  • Histone deacetylase 10
  • Histone deacetylase 11
  • Histone deacetylase 2
  • Histone deacetylase 3
  • Histone deacetylase 4
  • Histone deacetylase 5
  • Histone deacetylase 7
  • Histone deacetylase 8
  • Histone deacetylase 9
  • US8685992, 27
22 IC50
  • Low molecular weight phosphotyrosine protein phosphatase
  • RAC-alpha serine/threonine-protein kinase
  • Serine/threonine-protein kinase AKT
  • Serine/threonine-protein kinase AKT2
  • 1-{1-[(4-{7-phenyl-1H-imidazo[4,5-g]quinoxalin-6-yl}phenyl)methyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one
  • 3-[1-[4-(7-phenyl-3H-imidazo[4,5-g]quinoxalin-6-yl)benzyl]-4-piperidyl]-1H-benzimidazol-2-one
  • imidazoquinoxaline
  • imidazoquinoxaline 16h
22 IC50
  • 1,3-beta-glucan synthase component GLS2
  • Cytochrome P450 3A
  • Sodium channel alpha subunit
  • 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 8 subunit alpha
  • Sodium channel protein type 9 subunit alpha
  • Sodium channel protein type IX alpha subunit
  • Voltage-gated sodium channel subunit alpha Nav1.3 (Nav1.3)
  • Voltage-gated sodium channel subunit alpha Nav1.4 (Nav1.4)
  • US9012443, 261
19 IC50 3 Kd
  • Dual specificity protein kinase TTK
  • IRE1α
  • Interferon-induced, double-stranded RNA-activated protein kinase
  • Mitogen-activated protein kinase 10
  • Mitogen-activated protein kinase 14
  • Mitogen-activated protein kinase 8
  • Mitogen-activated protein kinase 9
  • TPA: Essential protein of the mitochondrial intermembrane space
  • Tyrosine-protein kinase JAK3
  • c-Jun N-terminal kinase, JNK
  • 14,15-diazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaen-8-one
  • CHEMBL7064
  • ChemBiol10705 Compound 4
  • JMC517015 Compound 2
  • SP 600125
  • SP-600125
  • SP600125
  • cid_8515
  • dibenzo[cd,g]indazol-6(2H)-one
8 Ki 8 IC50 6 EC50
  • Mu-type opioid receptor
  • US10231963, Table B.18
  • US10287250, Compound B.3
  • US10736890, Compound TABLE B.21
  • US10752592, Compound TABLE B.2
  • US9133125, Table B, Compound 2
  • US9656961, Example 00135
22 IC50
  • 72 kDa type IV collagenase
  • A disintegrin and metalloproteinase with thrombospondin motifs 4 (ADAMTS-4)
  • A disintegrin and metalloproteinase with thrombospondin motifs 5 (ADAMTS-5)
  • Collagenase 3
  • Interstitial collagenase
  • Matrix metalloproteinase 12
  • Matrix metalloproteinase 14
  • Matrix metalloproteinase-12 (MMP12)
  • Matrix metalloproteinase-14 (MMP14)
  • Matrix metalloproteinase-7 (MMP7)
  • Matrix metalloproteinase-9
  • Metalloproteinase with thrombospondin motifs 4 (ADAMTS-4)
  • Metalloproteinase with thrombospondin motifs 5 (ADAMTS-5)
  • Neutrophil collagenase
  • Stromelysin-1
  • US9206139, 2
22 IC50
  • 72 kDa type IV collagenase
  • A disintegrin and metalloproteinase with thrombospondin motifs 4 (ADAMTS-4)
  • A disintegrin and metalloproteinase with thrombospondin motifs 5 (ADAMTS-5)
  • Collagenase 3
  • Interstitial collagenase
  • Matrix metalloproteinase 12
  • Matrix metalloproteinase 14
  • Matrix metalloproteinase-12 (MMP12)
  • Matrix metalloproteinase-14 (MMP14)
  • Matrix metalloproteinase-7 (MMP7)
  • Matrix metalloproteinase-9
  • Metalloproteinase with thrombospondin motifs 4 (ADAMTS-4)
  • Metalloproteinase with thrombospondin motifs 5 (ADAMTS-5)
  • Neutrophil collagenase
  • Stromelysin-1
  • US9206139, 3
21 IC50 1 EC50
  • B-RAF V600E
  • C-RAF
  • RAF proto-oncogene serine/threonine-protein kinase
  • Serine/threonine-protein kinase B-raf
  • US10245267, Example 640
  • US10709712, Example 191
  • US9242969, 191
  • US9694016, 640
13 Ki 2 IC50 6 Kd
0 ΔG°
  • BET bromodomain 2(1) (BRD2(1))
  • BET bromodomain 2(1,2) (BRD2(1,2))
  • BET bromodomain 2(2) (BRD2(2))
  • BET bromodomain 3(1) (BRD3(1))
  • BET bromodomain 3(1,2) (BRD3(1,2))
  • BET bromodomain 3(2) (BRD3(2))
  • BET bromodomain 4 (BRD4)
  • BET bromodomain 4(1,2) (BRD4(1,2))
  • Bromodomain testis (1, 2) (BRDT(1,2))
  • Bromodomain testis 1 (BRDT(1))
  • Bromodomain testis 2 (BRDT(2))
  • Bromodomain-containing protein 4 (BRD4)
  • Bromodomain-containing protein 4 (BRD4) (aa 44-168)
  • (6S+2S)-PEG1 (7)
2 IC50 20 EC50
  • HCV NS3-NS4A Serine Proteinase
  • Hepatitis C virus NS5B RNA-dependent RNA polymerase
  • NS3 serine protease (NS3)
  • US9265773, 2
14 Ki 2 IC50 6 EC50
  • Cannabinoid receptor 1
  • Cannabinoid receptor 2
  • 3-[(2-iodo-5-nitrophenyl)carbonyl]-1-[(1-methylpiperidin-2-yl)methyl]-1H-indole
  • AM1241
22 Kd
  • M3 muscarinic receptor (M3'(3C)-Xa A177C)
  • M3 muscarinic receptor (M3'(3C)-Xa F550C)
  • M3 muscarinic receptor (M3'(3C)-Xa F554C)
  • M3 muscarinic receptor (M3'(3C)-Xa K178C)
  • M3 muscarinic receptor (M3'(3C)-Xa K548C)
  • M3 muscarinic receptor (M3'(3C)-Xa K555C)
  • M3 muscarinic receptor (M3'(3C)-Xa R176C)
  • M3 muscarinic receptor (M3'(3C)-Xa R179C)
  • M3 muscarinic receptor (M3'(3C)-Xa R551C)
  • M3 muscarinic receptor (M3'(3C)-Xa T180C)
  • M3 muscarinic receptor (M3'(3C)-Xa T549C)
  • M3 muscarinic receptor (M3'(3C)-Xa T552C)
  • M3 muscarinic receptor (M3'(3C)-Xa T553C)
  • M3 muscarinic receptor (M3'(3C)-Xa T556C)
  • M3 muscarinic receptor (M3'(3C)-Xa)
  • N-methylscopolamine (NMS)
22 IC50
  • Tyrosine-protein kinase BTK
  • Tyrosine-protein kinase JAK2
  • US10106559, Example 36
  • US10435415, Example 36
  • US9334290, 34
  • US9334290, 35
  • US9850258, Example 36
22 IC50
  • Tyrosine-protein kinase BTK
  • Tyrosine-protein kinase JAK2
  • US10106559, Example 61
  • US10435415, Example 61
  • US9334290, 60
  • US9334290, 61
  • US9334290, 62
  • US9850258, Example 61
1 Ki 21 IC50
  • Dual specificity protein phosphatase (VHR)
  • Dual specificity protein phosphatase VHX (VHX)
  • Fas-associated protein-tyrosine phosphatase 1 (FAP1)
  • Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP
  • Hematopoietic protein-tyrosine phosphatase (HEPTP)
  • Laforin
  • Leukocyte common antigen
  • Megakaryocyte protein-tyrosine phosphatase (PTP-MEG2)
  • Protein-tyrosine phosphatase
  • Protein-tyrosine phosphatase 1B
  • Protein-tyrosine phosphatase 1C
  • Receptor-type tyrosine-protein phosphatase F (LAR)
  • Receptor-type tyrosine-protein phosphatase beta (PTPβ)
  • Receptor-type tyrosine-protein phosphatase epsilon (PTPε)
  • Receptor-type tyrosine-protein phosphatase gamma
  • Receptor-type tyrosine-protein phosphatase mu (PTPμ)
  • Tyrosine-protein phosphatase non-receptor type 11
  • Tyrosine-protein phosphatase non-receptor type 12 (PTP-PEST)
  • Tyrosine-protein phosphatase non-receptor type 2
  • Tyrosine-protein phosphatase non-receptor type 3 (PTPH1)
  • Tyrosine-protein phosphatase non-receptor type 9 (PTP-MEG2)
  • US9340574, 7
22 IC50
  • 72 kDa type IV collagenase
  • Collagenase 3
  • Disintegrin and metalloproteinase domain-containing protein 17
  • Interstitial collagenase
  • Matrix metalloproteinase-14 (MMP14)
  • Matrix metalloproteinase-9
  • 4-({[4-(but-2-yn-1-yloxy)benzene]sulfonyl}methyl)-N-hydroxy-1-(propane-2-sulfonyl)piperidine-4-carboxamide
  • CHEMBL209970
  • beta-sulfonyl hydroxamate analogue, 4
18 Ki 4 IC50
  • Cereblon/Histone deacetylase 6
  • Histone deacetylase 1
  • Histone deacetylase 10
  • Histone deacetylase 2
  • Histone deacetylase 3
  • Histone deacetylase 8
  • Leukotriene A4 hydrolase
  • 3-[(dimethylamino)methyl]-N-{2-[4-(hydroxycarbamoyl)phenoxy]ethyl}-1-benzofuran-2-carboxamide
  • CRA-024781
10 Ki 12 IC50
  • P2X purinoceptor 7
  • P2X purinoceptor 7 (P2X7)
  • US10112937, Example 12
  • US10150765, Example 12
  • US10703749, Example 12
  • US9464084, 12
8 Ki 11 Kd 3 EC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A (5HT2A)
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor
  • Beta-3 adrenergic receptor
  • Mu-type opioid receptor
  • 2-hydroxy-5-{2-[(2-hydroxy-3-{4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]phenoxy}propyl)amino]ethoxy}benzamide; methanesulfonic acid
  • CGP 20712-A
  • CGP-20712A
  • cid_2685
22 IC50
  • 3',5'-cyclic phosphodiesterase
  • Homo sapiens phosphodiesterase 2A (PDE2A)
  • cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
  • US10023575, Example 55
  • US10023575, Example 83a
  • US10023575, Example 83b
  • US10023575, Example 84a
  • US10023575, Example 84b
  • US10479794, Example 84b
  • US10875867, Example 55
22 IC50
  • 3',5'-cyclic phosphodiesterase
  • Homo sapiens phosphodiesterase 2A (PDE2A)
  • cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
  • US10023575, Example 58
  • US10023575, Example 92a
  • US10023575, Example 92b
  • US10023575, Example 93a
  • US10023575, Example 93b
  • US10479794, Example 93b
  • US10875867, Example 58
1 Kd 21 EC50
  • 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
  • 2-methyl-2-phenoxypropanoic acid, 25a
  • 2-methyl-2-{4-[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}formamido)methyl]phenoxy}propanoic acid
  • CHEMBL219586
11 Ki 2 IC50 2 Kd 7 EC50
  • 5-hydroxytryptamine receptor 3A
  • Alpha-1A adrenergic receptor
  • Beta-secretase 1
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • D(4) dopamine receptor
  • G-protein subunit alpha-16
  • Norepinephrine transporter
  • Opioid receptor
  • Phenylethanolamine N-methyltransferase
  • Serotonin receptor 2a and 2b (5HT2A and 5HT2B)
  • Sodium-dependent dopamine transporter
  • Sodium-dependent serotonin transporter
  • TRAR1
  • Trace amine-associated receptor 1 (TAAR1)
  • TyR1
  • trace amine-associated receptor 1
  • CHEMBL11608
  • cid_5610
  • p-Tyramine
  • tyramine
13 Ki 4 IC50 5 EC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1B
  • 5-hydroxytryptamine receptor 1D
  • ADRA2A
  • Adrenergic receptor alpha
  • Adrenergic receptor alpha-2
  • Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • Bile salt export pump
  • Serotonin (5-HT) receptor
  • Sphingosine 1-phosphate receptor 3
  • exonuclease V (RecBCD complex), alpha chain
  • 2-(4-tert-butyl-2,6-dimethyl-benzyl)-2-imidazoline;hydrochloride
  • 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
  • 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
  • CHEMBL312448
  • MLS000069695
  • SMR000058526
  • XYLOMETAZOLINE HYDROCHLORIDE
  • Xylometazoline
  • cid_5282386
22 IC50
  • BZLF2
  • Dual Specificity Protein Phosphatase 1
  • Dual specificity phosphatase Cdc25B
  • Glyceraldehyde-3-phosphate dehydrogenase liver
  • Heat Shock 70kDa Protein 1
  • Hematopoietic protein-tyrosine phosphatase (HEPTP)
  • Induced myeloid leukemia cell differentiation protein Mcl-1
  • MKP-3
  • X-linked inhibitor of apoptosis protein (XIAP)
  • eukaryotic translation initiation factor 4 gamma, 1 isoform 4
  • heat shock 70kDa protein 8 isoform 2
  • large T antigen
  • nuclear receptor subfamily 4, group A, member 1
  • 8-carbethoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • 8-ethoxycarbonyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • MLS-0025126.0001
  • cid_2859888
22 IC50
  • PKC alpha and beta-2
  • Protein kinase C alpha type
  • Protein kinase C delta type
  • Protein kinase C, PKC; classical/novel
  • Protein kinase C, epsilon
  • Protein kinase C, eta
  • Protein kinase C, gamma
  • cAMP-Dependent Protein Kinase (PKA)
  • (+-)-anti-2-[[2,6-Dihydroxy-4-[[[2-(4-hydroxybenzyl)cyclopentyl]oxy]carbonyl]phenyl]carbonyl]-3-hydroxybenzoic acid
  • 2-{[2,6-dihydroxy-4-({[(1R,2S)-2-[(4-hydroxyphenyl)methyl]cyclopentyl]oxy}carbonyl)phenyl]carbonyl}-3-hydroxybenzoic acid
  • Acyclic Balanol Analog 29b
6 Ki 15 IC50 1 EC50
  • Coagulation factor X
  • Cytochrome P450 1A
  • Cytochrome P450 2B6
  • Cytochrome P450 2C19
  • Cytochrome P450 2C8
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Nuclear receptor subfamily 1 group I member 2
  • Plasminogen
  • Potassium voltage-gated channel subfamily H member 2
  • Prothrombin
  • Tissue-type plasminogen activator
  • Urokinase-type plasminogen activator
  • Vitamin K-dependent protein C
  • CHEMBL551991
  • cyanoguanidine, 3
22 IC50
  • Dual Specificity Protein Phosphatase 1
  • Dual specificity phosphatase Cdc25B
  • Genome polyprotein
  • Hematopoietic protein-tyrosine phosphatase (HEPTP)
  • MKP-3
  • eukaryotic translation initiation factor 4 gamma, 1 isoform 4
  • nuclear receptor subfamily 4, group A, member 1
  • 8-(cyclohexoxycarbonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • 8-[(cyclohexyloxy)carbonyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • 8-[cyclohexyloxy(oxo)methyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • 8-cyclohexyloxycarbonyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
  • MLS000042958
  • SMR000019385
  • cid_3243550
18 Ki
0 ΔG°
  • ADRA1B
  • Adrenergic receptor alpha-2
  • Alpha adrenergic receptor 1A and 1B
  • Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
  • Alpha-1A adrenergic receptor
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor
  • Cerebral cortex alpha adrenergic receptor
  • Serotonin (5-HT) receptor
  • adrenergic Alpha1
  • adrenergic Alpha2
  • (R)-(-)-phenylephrine
  • PHENYLEPHRINE
  • Phenylephrine,(-)
16 IC50 6 EC50
  • 3C-like protease
  • Apurinic-apyrimidinic endonuclease 1 (APE-1)
  • Axin-1/Glycogen synthase kinase-3 beta
  • BZLF2
  • DNA recombination protein RecA
  • G-protein coupled receptor 55
  • Lipoamide Dehydrogenase (Lpd)
  • POsterior Segregation family member (pos-1)
  • Pyruvate dehydrogenase (PDH)
  • RecName: Full=Zinc finger protein mex-5
  • Serine/threonine-protein kinase PLK1
  • Sphingosine 1-phosphate receptor 2
  • TCF4/beta-catenin
  • Valosin-containing protein
  • mothers against decapentaplegic homolog 3
  • nuclear receptor corepressor 2 isoform 2
  • photoreceptor-specific nuclear receptor
  • tyrosyl-DNA phosphodiesterase 2
  • 3-(4-Chloro-phenyl)-1,6-dimethyl-1H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
  • 3-(4-chlorophenyl)-1,6-dimethyl-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
  • 3-(4-chlorophenyl)-1,6-dimethyl-pyrimido[5,4-e][1,2,4]triazine-5,7-quinone
  • 3-(4-chlorophenyl)-1,6-dimethylpyrimido[5,4-e][1,2,4]triazine-5,7-dione
  • MLS000523518
  • SMR000122591
  • US9073941, 603
  • cid_460749
22 IC50
  • Ataxin-2
  • Carbonic anhydrase 2
  • US10647719, Example 3.00
  • US10647719, Example 3.01
  • US10647719, Example 3.02
  • US10647719, Example 3.03
  • US10647719, Example 3.04
  • US10647719, Example 3.05
  • US10647719, Example 3.06
  • US10647719, Example 3.07
  • US10647719, Example 3.08
  • US10647719, Example 3.09
  • US10647719, Example 3.10
21 IC50 1 EC50
  • 26S Proteasome regulatory subunit Rpn11 (Rpn11)
  • DNA (cytosine-5)-methyltransferase 1 (DNMT1)
  • Dual specificity protein phosphatase (VHR)
  • Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP
  • Hematopoietic protein-tyrosine phosphatase (HEPTP)
  • MKP-3
  • Thrombin
  • Tyrosine-protein phosphatase non-receptor type 11
  • carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1
  • tumor necrosis factor receptor superfamily member 10B isoform 1 precursor [Homo sapiens]
  • tyrosine-protein phosphatase non-receptor type 5 isoform a
  • MLS-0266851.0001
  • cid_2545467
17 IC50 5 Kd
  • BRAF
  • 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 5
  • Dual specificity mitogen-activated protein kinase kinase 6
  • Dual specificity mitogen-activated protein kinase kinase 7 (MAP2K7)
  • FLT3-ITD
  • Mast/stem cell growth factor receptor Kit
  • Proto-oncogene tyrosine-protein kinase Src
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • Receptor protein-tyrosine kinase erbB-4
  • Tyrosine-protein kinase BRK
  • Tyrosine-protein kinase BTK
  • Tyrosine-protein kinase Blk
  • Tyrosine-protein kinase Fgr
  • Tyrosine-protein kinase Fyn
  • Tyrosine-protein kinase Fyn (Y531F)
  • Tyrosine-protein kinase HCK
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase Lyn
  • Tyrosine-protein kinase Yes
  • flt3
  • (3S,4S)-3-((4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl)-1,2-dithiolan-4-ol
  • US10844038, Example 46 A.
22 IC50
  • Aurora kinase B
  • Epidermal growth factor receptor
  • Fibroblast growth factor receptor 1
  • Platelet-derived growth factor receptor beta
  • Serine/threonine-protein kinase Aurora-C
  • Tyrosine-protein kinase ZAP-70
  • Vascular endothelial growth factor receptor 1
  • Vascular endothelial growth factor receptor 2
  • (Z)-3-[2,4-dimethyl-5-(2-oxo-1,2-dihydro-indol-3-ylidenemethyl)-1H-pyrrol-3-yl]-propionic acid
  • 3-(2,4-dimethyl-5-{[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrol-3-yl)propanoic acid
  • CHEMBL274654
  • SU6668
17 Ki 3 IC50 2 Kd
  • Cholecystokinin receptor
  • GABA A Alpha2Beta1Gamma2
  • GABA A receptor alpha-3/beta-2/gamma-2
  • GABA A receptor alpha-6/beta-2/gamma-2
  • 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
  • GABA receptor alpha-6/beta-3/gamma-2 subunit
  • Gamma-aminobutyric acid receptor subunit alpha-1
  • Gamma-aminobutyric acid receptor subunit alpha-5 (GABA(A))
  • Platelet activating factor receptor
  • 8-chloro-6-(2-chlorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
  • CHEMBL646
  • Halcion
  • TRIAZOLAM
20 Ki 1 IC50 1 Kd
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • HTR2B
  • Monoamine oxidase
  • Serotonin 1 (5-HT1) receptor
  • Serotonin 1B/1D receptor
  • Serotonin 2 (5-HT2) receptor
  • Serotonin receptor 2a and 2b (5HT2A and 5HT2B)
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • (+/-)2-(2,5-Dimethoxy-4-methyl-phenyl)-1-methyl-ethylamine
  • (-)2-(2,5-Dimethoxy-4-methyl-phenyl)-1-methyl-ethylamine
  • (Rec)2-(2,5-Dimethoxy-4-methyl-phenyl)-1-methyl-ethylamine; compound with 2-(2,5-dimethoxy-4-methyl-phenyl)-1-methyl-ethylamine
  • 2-(2,5-Dimethoxy-4-methyl-phenyl)-1-methyl-ethylamine
  • 2-(2,5-Dimethoxy-4-methyl-phenyl)-1-methyl-ethylamine((R)-(-)-DOM)
  • 2-(2,5-Dimethoxy-4-methyl-phenyl)-1-methyl-ethylamine(DOM)
  • CHEMBL8600
  • DOM
  • DOM,R(-)
  • Racemic DOM
21 Ki 1 IC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1A (5HT1A)
  • 5-hydroxytryptamine receptor 1D
  • 5-hydroxytryptamine receptor 7
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Serotonin (5-HT) receptor
  • ((R)-8-Hydroxy-1,2,3,4-tetrahydro-naphthalen-2-yl)-dipropyl-ammonium
  • (8-Hydroxyl-1,2,3,4-tetrahydro-naphthalen-2-yl)-dipropyl-amine
  • (R)-7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen-1-ol
  • 7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen-1-ol
  • 7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen-1-ol ((R)-OH-DPAT)
  • 7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen-1-ol(8-OH-DPAT)
  • CHEMBL26998
  • R-(+)-7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen-1-ol
2 Ki 18 IC50 2 Kd
  • Bile salt export pump
  • Potassium channel protein TASK-1
  • Sodium channel alpha subunit
  • Sodium channel protein type 2 alpha subunit
  • Sodium channel protein type 5 subunit alpha
  • Sodium channel protein type 8 subunit alpha
  • Sodium channel protein type 9 subunit alpha
  • Sodium channel protein type I I alpha subunit
  • cGMP-gated cation channel alpha 1
  • 2-(Dimethylamino)ethyl p-(butylamino)benzoate
  • 2-(dimethylamino)ethyl 4-(butylamino)benzoate
  • CHEMBL698
  • Diaethylaminoaethanol ester der p-butylaminobenzoesaeure
  • TETRACAINE
  • p-Butylaminobenzoyl-2-dimethylaminoethanol
21 IC50
0 ΔG°
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Multidrug and toxin extrusion protein 1
  • Multidrug resistance-associated protein 4
  • Potassium channel protein TASK-1
  • Potassium channel subfamily K member 18
  • Potassium voltage-gated channel subfamily D member 2
  • Potassium voltage-gated channel subfamily H member 2
  • Sodium channel alpha subunit
  • Sodium channel protein type 5 subunit alpha
  • Sodium channel protein type 9 subunit alpha
  • Sodium channel protein type I I alpha subunit
  • Twik-RElated Potassium (K+) channel 1 (TREK1)
  • Voltage-gated L-type calcium channel alpha-1C subunit
  • Voltage-gated potassium channel subunit Kv1.5
  • 2-(Diethylamino)-2',6'-acetoxylidide
  • 2-(Diethylamino)-N-(2,6-dimethylphenyl)acetamide
  • CHEMBL79
  • Dalcaine
  • LIDOCAINE
  • Lignocaine
  • N-(2,6-dimethylphenyl)-N(2),N(2)-diethylglycinamide
  • Octocaine
  • SAMPL3, G5
11 Ki 11 IC50
  • 10 kDa chaperonin
  • 60 kDa chaperonin
  • Adrenergic Alpha
  • Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
  • Alpha-1A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Beta-2 adrenergic receptor
  • Bile salt export pump
  • D(2) dopamine receptor
  • DRD1
  • Dopamine receptor
  • HSP60/HSP10
  • Serotonin (5-HT) receptor
  • Sodium channel protein type I I alpha subunit
  • Solute carrier family 22 member 2
  • Solute carrier family 22 member 3
  • Thiosulfate sulfurtransferase
  • Benzyl-(2-chloro-ethyl)-(1-methyl-2-phenoxy-ethyl)-amine
  • CHEMBL753
  • Dibenzyline
  • PHENOXYBENZAMINE
22 Ki
  • 5-hydroxytryptamine receptor 2A
  • Alpha-1A adrenergic receptor
  • D(2) dopamine receptor
  • Muscarinic acetylcholine receptor M2
  • Norepinephrine Monoamine transporters
  • Norepinephrine transporter
  • Serotonin 2 (5-HT2) receptor
  • Sodium-dependent dopamine transporter
  • Sodium-dependent serotonin transporter
  • 4-(3,4-Dichloro-phenyl)-7-methoxy-2-methyl-1,2,3,4-tetrahydro-isoquinoline
  • 4-(3,4-Dichloro-phenyl)-7-methoxy-2-methyl-1,2,3,4-tetrahydro-isoquinoline(Diclofensive)
  • CHEMBL287257
  • DICLOFENSINE,(+)
  • DICLOFENSINE,(-)
  • Diclofensine
8 Ki 14 IC50
  • 17-beta-hydroxysteroid dehydrogenase type 3
  • Acetylcholinesterase
  • Aldose reductase
  • Aldose reductase (AR)
  • Amine oxidase [flavin-containing] B
  • Butyrylcholinesterase (BuChE)
  • Carbonic anhydrase 1
  • Carbonic anhydrase 12
  • Carbonic anhydrase 2
  • Carbonic anhydrase 9
  • Cholinesterase
  • Non-structural protein 5B (NS5B)
  • Nuclear factor NF-kappa-B (NF-kB)
  • Sorbitol dehydrogenase
  • Uridine-5'-diphosphoglucuronosyltransferase 1A1
  • dTDP-4-dehydrorhamnose 3,5-epimerase RmlC
  • 4-Methyl-7-hydroxycoumarin
  • 4-methylumbelliferone
  • 7-Hydroxy-4-methyl-2-oxo-2H-1-benzopyran
  • 7-Hydroxy-4-methyl-2-oxo-3-chromene
  • 7-Hydroxy-4-methyl-2H-1-benzopyran-2-one
  • 7-Hydroxy-4-methyl-2H-2-one (1)
  • 7-Hydroxy-4-methylcoumarin
  • 7-hydroxy-4-methyl-2H-chromen-2-one
  • CHEMBL12208
  • Coumarin derivative, 3b
  • Imecromone
  • beta-Methylumbelliferone
  • cid_5280567
6 Ki 16 EC50
  • Monoamine Oxidase Type B (MAO-B)
  • Monoamine oxidase
  • Phenylethanolamine N-methyltransferase
  • Sigma non-opioid intracellular receptor 1
  • Trace amine-associated receptor 1
  • Trace amine-associated receptor 1 (TAAR1)
  • trace amine-associated receptor 1
  • (R)-amphetamine
  • AMPHETAMINE
  • CHEMBL19393
4 Ki 15 IC50 2 Kd 1 EC50
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cytochrome P450 2C9
  • Genome polyprotein
  • Multidrug resistance-associated protein 4
  • Serum albumin
  • Solute carrier family 22 member 6
  • Sterol 14α-demethylase (CYP51)
  • Twik-RElated Potassium (K+) channel 1 (TREK1)
  • Uridine-5'-diphosphoglucuronosyltransferase 1A1
  • Uridine-5'-diphosphoglucuronosyltransferase 1A4
  • Uridine-5'-diphosphoglucuronosyltransferase 1A6
  • Uridine-5'-diphosphoglucuronosyltransferase 2B10
  • Uridine-5'-diphosphoglucuronosyltransferase 2B7
  • 1-Butyl-3-(p-methylphenylsulfonyl)urea
  • 1-Butyl-3-(p-tolylsulfonyl)urea
  • 1-Butyl-3-tosylurea
  • CHEMBL782
  • N-(4-Methylphenylsulfonyl)-N'-butylurea
  • N-Butyl-N'-(4-methylphenylsulfonyl)urea
  • N-Butyl-N'-(p-tolylsulfonyl)urea
  • N-[(butylamino)carbonyl]-4-methylbenzenesulfonamide
  • N-n-Butyl-N'-tosylurea
  • Orinase (TN)
  • TOLBUTAMIDE
12 IC50 6 Kd 4 EC50
  • Cellular retinoic acid-binding protein I
  • Cellular retinoic acid-binding protein II
  • Retinoic acid receptor RXR-alpha
  • Retinoic acid receptor alpha
  • Retinoic acid receptor beta
  • Retinoic acid receptor gamma
  • Retinoid X receptor alpha
  • (2E,4E,6E)-8-[3-Ethyl-2-isopropyl-cyclohex-2-en-(E)-ylidene]-3,7-dimethyl-octa-2,4,6-trienoic acid
  • CHEMBL46398
11 Ki 11 IC50
  • 72 kDa type IV collagenase
  • Immunoglobulin epsilon Fc receptor
  • Interstitial collagenase
  • Matrix metalloproteinase-7 (MMP7)
  • Matrix metalloproteinase-9
  • Neutrophil collagenase
  • Procathepsin L
  • Stromelysin-1
  • (N-(2-HYDROXAMATEMETHYLENE-4-METHYL-PENTOYL)PHENYLALANYL)METHYL AMINE
  • (R)-N*4*-Hydroxy-2-isobutyl-N*1*-((S)-1-methylcarbamoyl-2-phenyl-ethyl)-succinamide
  • (R)-N4-hydroxy-2-isobutyl-N1-((S)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl)succinamide
  • CHEMBL11306
  • METHYLAMINO-PHENYLALANYL-LEUCYL-HYDROXAMIC ACID
21 IC50 1 EC50
  • 3',5'-cyclic phosphodiesterase
  • Phosphodiesterase 3
  • Phosphodiesterase 4
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4A
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4B
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4C
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4C isoform 1
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4D
  • (-)-rolipram
  • (4R)-4-[3-(cyclopentyloxy)-4-methoxyphenyl]pyrrolidin-2-one
  • (R)-(-)-rolipram
  • (R)-rolipram
  • CHEMBL430893
9 Ki 13 IC50
  • Angiotensin II AT1B
  • Angiotensin II receptor
  • Angiotensin II receptor (AT-1) type-1
  • Bile acid transporter
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 2
  • Endothelin-1 receptor
  • Multidrug and toxin extrusion protein 1
  • Multidrug resistance-associated protein 4
  • Potassium voltage-gated channel subfamily H member 2
  • 2-butyl-3-{[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl}-1,3-diazaspiro[4.4]non-1-en-4-one
  • 2-butyl-3-{[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1,3-diazaspiro[4.4]non-1-en-4-one
  • BMS 186295
  • CHEMBL1513
  • IRBESARTAN
3 Ki 18 IC50 1 Kd
  • Aldose reductase
  • Angiotensin-converting enzyme
  • Arachidonate 5-lipoxygenase
  • Beta-secretase 1
  • Cyclin-dependent kinase 2
  • Cyclooxygenase
  • Enoyl-ACP Reductase (FabI)
  • Enoyl-acyl-carrier protein reductase
  • Epidermal growth factor receptor
  • Estradiol 17-beta-dehydrogenase 2
  • Human immunodeficiency virus type 1 integrase
  • Proto-oncogene tyrosine-protein kinase Src
  • Xanthine dehydrogenase
  • (E)-1-(2,4-dihydroxyphenyl)-3-(3,4-dihydroxyphenyl)-2-propen-1-one (21)
  • (E)-1-(2,4-dihydroxyphenyl)-3-(3,4-dihydroxyphenyl)prop-2-en-1-one
  • (E)-3-(3,4-Dihydroxy-phenyl)-1-(2,4-dihydroxy-phenyl)-propenone
  • 3,4,2',4'-tetrahydroxychalone
  • 3-(3,4-Dihydroxy-phenyl)-1-(2,4-dihydroxy-phenyl)-propenone
  • Butein
  • CHEMBL128000
18 Ki 4 IC50
  • Delta-type opioid receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • (+)-N-phenethyl trans-3(R),4(R)-dimethyl-4-(3-hydroxyphenyl)piperidine
  • 3-((3R,4R)-3,4-Dimethyl-1-phenethyl-piperidin-4-yl)-phenol
  • 3-(3,4-Dimethyl-1-phenethyl-piperidin-4-yl)-phenol
  • 3-(trans-3,4-dimethyl-1-phenethylpiperidin-4-yl)phenol
  • CHEMBL319536
  • N-phenethyltrans-3,4-dimethyl-4-(3-hydroxyphenyl)piperidine
8 Ki 8 IC50 1 Kd 5 EC50
  • GHS-R1a:GHS-R1a
  • GHS-R1a:GHS-R1aE124Q
  • GHS-R1a:GHS-R1b
  • Ghrelin receptor
  • 1-{[(2R)-3-(benzyloxy)-1-{1-methanesulfonyl-1,2-dihydrospiro[indole-3,4'-piperidine]-1'-yl}-1-oxopropan-2-yl]carbamoyl}-1-methylethan-1-aminium
  • 1N-[1-benzyloxymethyl-2-[1-methylsulfonylspiro[2,3-dihydro-1H-indole-3,4'-(hexahydropyridine)]-1-yl]-2-oxo-(1R)-ethyl]-2-amino-2-methylpropanamide
  • 1N-[1-benzyloxymethyl-2-[1-methylsulfonylspiro[2,3-dihydro-1H-indole-3,4'-(hexahydropyridine)]-1-yl]-2-oxo-(1R)-ethyl]-2-amino-2-methylpropanamide [3a(MK-0677)]
  • 1N-[1-benzyloxymethyl-2-[1-methylsulfonylspiro[2,3-dihydro-1H-indole-3,4'-(hexahydropyridine)]-1-yl]-2-oxo-(1R)-ethyl]-2-amino-2-methylpropanamide(MK-0677)
  • CHEMBL13817
  • MK 0677
  • MK-0677
  • MK-677
15 Ki 5 IC50
0 ΔG°
  • Acetylcholinesterase
  • Acetylcholinesterase (AChE)
  • Cholinergic, Nicotinic Alpha6
  • Cholinergic, Nicotinic Alpha6Beta2
  • Cholinergic, Nicotinic Alpha6Beta4
  • Histamine H3 receptor
  • Muscarinic acetylcholine receptor M2
  • Neuronal acetylcholine receptor
  • Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit
  • Neuronal acetylcholine receptor subunit alpha-4
  • Phospholipase B
  • Sigma non-opioid intracellular receptor 1
  • n-AChR
  • 1,10-Bis(trimethyl ammonium)decane dibromide
  • 1,10-bis-(trimethyl ammonium) decane dibromide
  • CHEMBL1134
  • DECAMETHONIUM
  • DECAMETHONIUM BROMIDE
  • Decamethonium Iodide
  • N,N,N'',N''-Tetramethyl-decane-1,10-diammonium; dibromide
  • N,N,N,N'',N'',N''-Hexamethyldecane-1,10-diammoniumdibromide
  • Syncurine
  • decane-1,10-bis(trimethylammonium bromide)
21 Ki 1 EC50
  • Muscarinic acetylcholine receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M2 and M5
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit
  • 6-acetoxy-8-methyl-8-azonia-bicyclo[3.2.1]octane
  • Acetic acid 8-methyl-8-aza-bicyclo[3.2.1]oct-6-yl ester
  • CHEMBL294273
8 Ki 14 IC50
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • NK-3 receptor
  • Neurokinin 1 receptor
  • Neurokinin 2 receptor
  • Neurokinin 3 receptor
  • Neuromedin-K receptor
  • Potassium voltage-gated channel subfamily H member 2
  • CHEMBL3422009
  • US10544150, Compound 156
20 Ki 2 IC50
  • Adenosine Receptors A2a (A2a)
  • Adenosine receptor A1
  • Adenosine receptor A2a
  • Adenosine receptor A2b
  • Adenosine receptor A3
  • 1-(3-Chloro-phenyl)-3-(8-ethyl-2-furan-2-yl-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)-urea
  • 1-(3-chlorophenyl)-3-(8-ethyl-2-(furan-2-yl)-8H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)urea
  • CHEMBL141154
9 Ki 11 IC50 2 EC50
  • Delta-type opioid receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • Nociceptin receptor
  • 1-((3R,4R)-1-Cyclooctylmethyl-3-hydroxymethyl-piperidin-4-yl)-3-ethyl-1,3-dihydro-benzoimidazol-2-one
  • 1-[(3R,4R)-1-cyclooctylmethyl-3-hydroxymethyl-4-piperidinyl]-3-ethyl-1,3-dihydro-2H-benzimidazol-2-one
  • 1-[(3R,4R)-1-cyclooctylmethyl-3-hydroxymethyl-4-piperidyl]-3-ethyl-1,3-dihydro-2H-benzimidazol-2-one
  • CHEMBL357076
  • J-113397
1 IC50 3 Kd 17 EC50
0 ΔG°
  • Intestinal fatty acid-binding protein (hIFABP)
  • Peroxisome proliferator-activated receptor
  • Peroxisome proliferator-activated receptor alpha (PPAR alpha)
  • Peroxisome proliferator-activated receptor delta
  • Peroxisome proliferator-activated receptor gamma
  • 2-(4-(3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy)phenoxy)acetic acid
  • CHEMBL153057
  • L-165041
  • L165041
  • {4-[3-(4-Acetyl-3-hydroxy-2-propyl-phenoxy)-propoxy]-phenoxy}-acetic acid(L-165041)
  • {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid
9 Ki 13 IC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • 5-Methyl-6-trifluoromethyl-2,3-dihydro-indole-1-carboxylic acid [6-(2-methyl-pyridin-3-yloxy)-pyridin-3-yl]-amide
  • 5-methyl-N-(6-(2-methylpyridin-3-yloxy)pyridin-3-yl)-6-(trifluoromethyl)indoline-1-carboxamide
  • CHEMBL14460
  • SB-243213
16 Ki 6 IC50
  • Dihydrofolate Reductase (DHFR)
  • Dihydrofolate Reductase-Thymidylate Synthase (DHFR-TS) Mutant KICB1
  • Dihydrofolate reductase
  • Dihydrofolate reductase (A16V+S108T)
  • Dihydrofolate reductase type 1
  • Thymidylate synthase (TS)
  • 1-(3-Chloro-phenyl)-6,6-dimethyl-1,6-dihydro-[1,3,5]triazine-2,4-diamine
  • 1-(3-chlorophenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine
  • CHEMBL7130
21 IC50 1 EC50
  • Calcium channel (Type L)
  • Cytochrome P450 2C8
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Neurokinin 2 receptor
  • Nuclear receptor subfamily 1 group I member 2
  • Phosphodiesterase 4
  • Potassium voltage-gated channel subfamily H member 2
  • Sodium channel protein type 5 subunit alpha
  • Somatostatin receptor 3
  • Somatostatin receptor subtype 3
  • Somatostatin receptor type 1
  • Somatostatin receptor type 2
  • Somatostatin receptor type 3
  • Somatostatin receptor type 4
  • Somatostatin receptor type 5
  • CHEMBL3582336
22 Ki
  • Coagulation factor IX
  • Coagulation factor VII
  • Coagulation factor X
  • Coagulation factor XI
  • Plasma kallikrein
  • Plasminogen
  • Prothrombin
  • Tissue-type plasminogen activator
  • Trypsin
  • Urokinase-type plasminogen activator
  • Vitamin K-dependent protein C
  • CHEMBL3393386
20 IC50 2 Kd
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Canalicular multispecific organic anion transporter 2
  • Catechol O-methyltransferase
  • Catechol-O-methyltransferase
  • Dengue virus type 2 NS3 protein
  • Krueppel-like factor 10
  • Lanosterol synthase
  • Multidrug resistance-associated protein 4
  • Transthyretin
  • (3,4-Dihydroxy-5-nitro-phenyl)-p-tolyl-methanone
  • (3,4-dihydroxy-5-nitrophenyl)(p-tolyl)methanone
  • CHEMBL1324
  • Ro-40-7592
  • TOLCAPONE
  • Talcapone
  • Tasmar
2 Ki 2 IC50 18 EC50
  • Peroxisome proliferator-activated receptor
  • Peroxisome proliferator-activated receptor alpha (PPAR alpha)
  • (2S)-2-ETHOXY-3-{4-[2-(10H-PHENOXAZIN-10-YL)ETHOXY]PHENYL}PROPANOIC ACID
  • (S)-2-Ethoxy-3-[4-(2-phenoxazin-10-yl-ethoxy)-phenyl]-propionic acid
  • 2-Ethoxy-3-[4-(2-phenoxazin-10-yl-ethoxy)-phenyl]-propionic acid
  • 2-Ethoxy-3-[4-(2-phenoxazin-10-yl-ethoxy)-phenyl]-propionic acid(-) DRF 2725
  • CHEMBL24038
  • Ragaglitazar
13 Ki 9 IC50
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Neurokinin 1 receptor
  • Neurokinin 2 receptor
  • Neurokinin 3 receptor
  • Neuromedin-K receptor
  • Neuromedin-K receptor (NK-3 receptor)
  • hnk-3
  • CHEMBL3608682
  • US10030025, Compound 28
  • US10836768, Cpd no 28
  • US9422299, 28
  • US9987274, Compound 28
22 Ki
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • D(2) dopamine receptor
  • Serotonin (5-HT) receptor
  • Serotonin 2 (5-HT2) receptor
  • Serotonin 4 (5-HT4) receptor
  • 2a-(4-(4-phenyl-5,6-dihydropyridin-1(2H)-yl)butyl)-2a,3,4,5-tetrahydrobenzo[cd]indol-2(1H)-one
  • 2a-[4-(4-Phenyl-3,6-dihydro-2H-pyridin-1-yl)-butyl]-2a,3,4,5-tetrahydro-1H-benzo[cd]indol-2-one
  • CHEMBL69257
17 Ki 1 IC50 4 EC50
  • Adenosine A2 receptor
  • Adenosine Receptors A2a (A2a)
  • Adenosine receptor
  • Adenosine receptor A1
  • Adenosine receptor A2a
  • Adenosine receptor A2b
  • (2R,3R,4S,5R)-2-(6-Amino-2-hex-1-ynyl-purin-9-yl)-5-hydroxymethyl-tetrahydro-furan-3,4-diol
  • (2R,3R,4S,5R)-2-(6-amino-2-(hex-1-ynyl)-9H-purin-9-yl)-5-(hydroxymethyl)-tetrahydrofuran-3,4-diol
  • (2R,3R,4S,5R)-2-(6-amino-2-(hex-1-ynyl)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • 2-(l-hexyn-l-yl)adenosine (7)
  • CHEMBL319387
21 Ki 1 EC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • D(1A) dopamine receptor
  • D(1B) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • CHEMBL142020
  • N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)H-pyrazolo[1,5-a]pyridine-2-carboxamide
  • Pyrazolo[1,5-a]pyridine-2-carboxylic acid {4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-amide
17 Ki 5 IC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 5A
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • Serotonin (5-HT) receptor
  • 2-{2-[4-(5-Fluoro-2-oxo-2,3-dihydro-benzoimidazol-1-yl)-piperidin-1-yl]-ethyl}-2,3,4,5-tetrahydro-benzo[c]azepin-1-one
  • CHEMBL273921
19 Ki 1 IC50 2 EC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2C
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • 9H-Fluorene-2-carboxylic acid {(E)-4-[4-(2,3-dichloro-phenyl)-piperazin-1-yl]-but-2-enyl}-amide
  • 9H-Fluorene-2-carboxylic acid {4-[4-(2,3-dichloro-phenyl)-piperazin-1-yl]-but-2-enyl}-amide
  • CHEMBL304605
  • N-(4-(4-(2,3-dichlorophenyl)piperazin-1-yl)but-2-enyl)-9H-fluorene-2-carboxamide
5 Ki 17 IC50
  • Androgen Receptor
  • Arylacetamide deacetylase
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Carboxylesterase 2
  • Multidrug resistance-associated protein 4
  • 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
  • 4'-nitro-3'-trifluoromethylisobutyranilide
  • CHEMBL806
  • Eulexin
  • FLUTAMIDE
  • Niftolide
  • alpha,alpha,alpha-trifluoro-2-methyl-4'-nitro-m-propionotoluidide
  • niftolid
16 Ki 4 IC50 2 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 3A
  • 5-hydroxytryptamine receptor 4 (5-HT4)
  • 5-hydroxytryptamine receptor 5A
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Adrenergic receptor alpha-2
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2C adrenergic receptor
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • 1-Methyl-2-(3,7,8,9-tetrahydro-pyrano[3,2-e]indol-1-yl)-ethylamine
  • CHEMBL133868
3 Ki 19 IC50
  • Axin-1/Glycogen synthase kinase-3 beta
  • Beta-secretase 1
  • Thymidine Phosphorylase (TP)
  • Thymidine phosphorylase
  • Thymidine phosphorylase (TP)
  • Xanthine dehydrogenase
  • 1,7-Dihydro-pyrrolo[2,3-d]pyrimidine-2,4-dione
  • 7-Deazaxanthine (7DX)
  • 7-deazaxanthine
  • CHEMBL122899
14 Ki 2 IC50 6 EC50
  • Delta-type opioid receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • CHEMBL147511
  • MCL-144
  • di[17-cyclobutylmethyl-(1R,9R,10R)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-yl] sebacate
22 IC50
  • 72 kDa type IV collagenase
  • Cereblon/Histone deacetylase 6
  • Collagenase 3
  • Disintegrin and metalloproteinase domain-containing protein 17
  • Histone deacetylase 1
  • Histone deacetylase 10
  • Histone deacetylase 11
  • Histone deacetylase 2
  • Histone deacetylase 3
  • Histone deacetylase 4
  • Histone deacetylase 5
  • Histone deacetylase 7
  • Histone deacetylase 8
  • Histone deacetylase 9
  • Interstitial collagenase
  • Matrix metalloproteinase 10
  • Matrix metalloproteinase-12 (MMP12)
  • Matrix metalloproteinase-14 (MMP14)
  • Matrix metalloproteinase-7 (MMP7)
  • Matrix metalloproteinase-9
  • Neutrophil collagenase
  • Stromelysin-1
  • CHEMBL3394285
22 IC50
  • Hepatocyte growth factor receptor
  • Vascular endothelial growth factor receptor 1
  • Vascular endothelial growth factor receptor 2
  • Vascular endothelial growth factor receptor 3
  • CHEMBL3765306
1 Ki 2 IC50 1 Kd 18 EC50
  • Ectonucleotide pyrophosphatase/phosphodiesterase family member 2
  • Lysophosphatidic acid receptor 1
  • Lysophosphatidic acid receptor 3 (LPAR3)
  • Lysophosphatidic acid receptor 4
  • Lysophosphatidic acid receptor 5 (LPA5)
  • Lysophosphatidic acid receptor 6
  • Lysophosphatidic acid receptor Edg-4
  • (R)-Octadec-9-enoic acid 2-hydroxy-3-phosphonooxy-propyl ester
  • 1-oleoyl lysophosphatidic acid
  • CHEMBL117021
  • lysophosphatidic acid
21 IC50 1 EC50
  • 12-Lipoxygenase (12-LOX)
  • Angiopoietin-1 receptor
  • Arachidonate 15-lipoxygenase
  • Aurora kinase A/Targeting protein for Xklp2
  • Aurora kinase B
  • Cyclin-Dependent Kinase 4 (CDK4)
  • Ephrin type-B receptor 4
  • Epidermal growth factor receptor
  • Focal adhesion kinase 1
  • Hepatocyte growth factor receptor
  • Insulin receptor
  • Insulin-like growth factor I receptor
  • Mitogen-activated protein kinase kinase kinase 8
  • NUAK family SNF1-like kinase 1
  • Platelet-derived growth factor receptor beta
  • Proto-oncogene tyrosine-protein kinase Src
  • Receptor tyrosine-protein kinase erbB-2
  • Ryanodine receptor 1
  • Serine/threonine-protein kinase PLK4
  • Tyrosine-protein kinase receptor FLT3
  • Vascular endothelial growth factor receptor 2
  • Vascular endothelial growth factor receptor 3
  • Bastadin-7
  • Bastadins 7
  • CHEMBL360190
  • bastadin 7
  • polybrominated diphenyl ether derivative
5 Ki 14 IC50 3 Kd
  • Acetylcholinesterase
  • Cyclooxygenase
  • Fatty acid binding protein muscle
  • Fatty acid-binding protein 4 (FABP4)
  • Fatty acid-binding protein 5 (FABP5)
  • Fatty acid-binding protein 5 (FABP5)(DSm)
  • Fatty acid-binding protein 5 (FABP5)(NLSm)
  • Intestinal fatty acid-binding protein (hIFABP)
  • Peroxisome proliferator-activated receptor
  • Prostaglandin G/H synthase (Cyclooxygenase-2)
  • Protein-tyrosine phosphatase 1B
  • Toll-like receptor 2 (TLR2)
  • Vanilloid receptor
  • 1-HEXYLDECANOIC ACID
  • CHEMBL82293
  • Hexadecanoic acid
  • Hexadecanoic acid anion
  • Palmitic acid (PA)
14 Ki 8 IC50
  • 1,3-beta-glucan synthase component GLS2
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M3
  • CHEMBL3775589
  • US10273244, Example 12
  • US10584135, Example 12
22 IC50
  • Beta-lactamase
  • Beta-lactamase (TEM-1)
  • Beta-lactamase 2
  • Beta-lactamase AmpC
  • Beta-lactamase L1
  • Beta-lactamase TEM
  • Beta-lactamase class C
  • Beta-lactamase type II
  • CHEMBL1439
  • CL-307579
  • Sodium; (2S,3S,5R)-3-methyl-4,4,7-trioxo-3-[1,2,3]triazol-1-ylmethyl-4lambda*6*-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylate
  • TAZOBACTAM SODIUM
  • US9035062, TAZ
  • sodium (2S,3S,5R)-3-methyl-4,4,7-trioxo-3-[1,2,3]triazol-1-ylmethyl-4lambda6-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylate
  • tazobactum
21 Ki 1 IC50
  • 5-hydroxytryptamine receptor 2B
  • Adenosine A1 receptor
  • Adenosine A2a receptor
  • Adenosine receptor A1
  • Adenosine receptor A2a
  • Adenosine receptor A2a and A3
  • Adenosine receptor A3
  • (1S,2R,3S,4R,5S)-4-(6-(3-chlorobenzylamino)-2-chloro-9H-purin-9-yl)-2,3-dihydroxy-N-methylbicyclo[3.1.0]hexane-1-carboxamide
  • (1S,2R,3S,4R,5S)-4-[2-Chloro-6-(3-chloro-benzylamino)-purin-9-yl]-2,3-dihydroxy-bicyclo[3.1.0]hexane-1-carboxylic acid methylamide
  • 1N-methyl-4-[2-chloro-6-(3-chlorobenzylamino)-9H-9-purinyl]-2,3-dihydroxy-(1S,2R,3S,4R,5S)-bicyclo[3.1.0]hexane-1-carboxamide
  • CHEMBL175543
22 IC50
  • C-C chemokine receptor type 1
  • C-C chemokine receptor type 2
  • C-C chemokine receptor type 3
  • C-C chemokine receptor type 5
  • C-X-C chemokine receptor type 1
  • C-X-C chemokine receptor type 2
  • Cytochrome P450 2D6 (2D6)
  • 1-((1R,2S)-2-(((S)-3-(4-fluorobenzyl)piperidin-1-yl)methyl)cyclohexyl)-3-(3-(1-methyl-1H-tetrazol-5-yl)phenyl)urea
  • 1-{(1R,2S)-2-[(S)-3-(4-Fluoro-benzyl)-piperidin-1-ylmethyl]-cyclohexyl}-3-[3-(1-methyl-1H-tetrazol-5-yl)-phenyl]-urea
  • CHEMBL363840
3 Ki 19 IC50
  • Dihydrofolate reductase
  • Folate receptor alpha
  • Folate receptor beta
  • Folate transporter 1
  • GAR transformylase
  • Glycinamide ribonucleotide formyltransferase (GARFTase)
  • Proton-coupled folate transporter
  • Thymidylate Synthase (TS)
  • Thymidylate synthase
  • Thymidylate synthase/GAR transformylase/AICAR transformylase
  • (S)-2-(4-(3-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-6-yl)propyl)benzamido)pentanedioic acid
  • (S)-2-{4-[3-(2-Amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-6-yl)-propyl]-benzoylamino}-pentanedioic acid
  • CHEMBL192632
10 Ki 12 IC50
  • Histamine H1 receptor
  • Neurokinin 1 receptor
  • Neurokinin 2 receptor
  • Neuromedin-K receptor
  • TACR2
  • TACR3
  • 1-{2-[(R)-3-(3,4-Dichloro-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl}-4-phenyl-piperidine-4-carboxylic acid amide
  • 3-((E)-3-Carboxy-3-phenyl-allyl)-4,6-dichloro-1H-indole-2-carboxylic acid
  • CHEMBL330366
  • MDL 104,335 (S)-enantiomer
  • MDL-105212
10 Ki 7 IC50 5 EC50
  • Oxytocin receptor
  • Vasopressin V1a receptor
  • Vasopressin V1b receptor
  • Vasopressin V2 receptor
  • (5H,11H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-10-yl)-[2-chloro-4-(3-methyl-pyrazol-1-yl)-phenyl]-methanone
  • (5H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-10(11H)-yl)(2-chloro-4-(3-methyl-1H-pyrazol-1-yl)phenyl)methanone
  • CHEMBL363910
  • VNA-932
  • WAY-VNA-932
12 Ki 10 IC50
  • Delta-type opioid receptor
  • Mu-opioid receptor
  • Mu-type opioid receptor
  • Opioid receptors; mu & delta
  • (S)-N-((1H-benzo[d]imidazol-2-yl)methyl)-2-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
  • 2-[2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionyl]-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid (1H-benzoimidazol-2-ylmethyl)-amide
  • CHEMBL109390
  • H-Dmt-Tic-NH-CH2-Bid
  • UFP-502
22 IC50
  • Collagenase 3
  • Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10)
  • Disintegrin and metalloproteinase domain-containing protein 17
  • Disintegrin and metalloproteinase domain-containing protein 9 (ADAM9)
  • Interstitial collagenase
  • Matrix metalloproteinase-9
  • Stromelysin-1
  • (S)-N-hydroxy-4-(4-(4-hydroxybut-2-ynyloxy)phenylsulfonyl)-2,2-dimethylthiomorpholine-3-carboxamide
  • CHEMBL206815
  • TMI-05
  • US9266848, Apratastat
  • US9365529, Apratastat
18 IC50 4 Kd
  • 14-alpha sterol demethylase
  • 14-alpha sterol demethylase Cyp51A
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cytochrome P450 11B1
  • Cytochrome P450 11B2
  • Cytochrome P450 17A1
  • Cytochrome P450 19A1
  • Cytochrome P450 2C9
  • Cytochrome P450 3A
  • Lanosterol 14-alpha demethylase
  • Multidrug resistance-associated protein 4
  • Sterol 14-alpha demethylase (CYP51)
  • 4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)-tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-((2S,3S)-2-hydroxypentan-3-yl)-2H-1,2,4-triazol-3(4H)-one
  • 4-(4-(4-(4-(((5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)-tetrahydrofuran-3-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-((2S,3S)-2-hydroxypentan-3-yl)-2H-1,2,4-triazol-3(4H)-one
  • 4-[4-(4-{4-[(R)-5-(2,4-difluoro-phenyl)-5-(4,5-dihydro-[1,2,4]triazol-1-ylmethyl)-tetrahydro-furan-3-ylmethoxy]-phenyl}-piperazin-1-yl)-phenyl]-2-((1S,2S)-1-ethyl-2-hydroxy-propyl)-2,4-dihydro-[1,2,4]triazol-3-one
  • CHEMBL1397
  • Noxafil
  • POSACONAZOLE
  • pasaconazole
16 Ki 6 IC50
  • Prostaglandin E2 receptor
  • Prostaglandin E2 receptor EP1 subtype (EP1)
  • Prostaglandin E2 receptor EP2 subtype
  • Prostaglandin E2 receptor EP4 subtype
  • Prostaglandin F2-alpha receptor
  • Prostanoid DP receptor
  • Prostanoid IP receptor
  • Prostanoid TP receptor
  • 2-((R)-4-(4-chlorobenzyl)-5-(1-hydroxyethyl)-7-(methylsulfonyl)-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetic acid
  • CHEMBL207203
  • [(3R)-4-(4-chlorobenzyl)-5-(1-hydroxyethyl)-7-(methylsulfonyl)-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl]acetic acid
22 IC50
  • Mast/stem cell growth factor receptor Kit
  • Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
  • Platelet-derived growth factor receptor alpha
  • Proto-oncogene tyrosine-protein kinase Src
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • Tyrosine-protein kinase ABL1
  • Tyrosine-protein kinase Blk
  • Tyrosine-protein kinase FRK
  • Tyrosine-protein kinase Fgr
  • Tyrosine-protein kinase Fyn
  • Tyrosine-protein kinase HCK
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase Lyn
  • Tyrosine-protein kinase Yes
  • CHEMBL3823861
  • US10294227, Code 221
22 IC50
  • Mast/stem cell growth factor receptor Kit
  • Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
  • Platelet-derived growth factor receptor alpha
  • Proto-oncogene tyrosine-protein kinase Src
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • Tyrosine-protein kinase ABL1
  • Tyrosine-protein kinase Blk
  • Tyrosine-protein kinase FRK
  • Tyrosine-protein kinase Fgr
  • Tyrosine-protein kinase Fyn
  • Tyrosine-protein kinase HCK
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase Lyn
  • Tyrosine-protein kinase Yes
  • CHEMBL3823212
  • US10294227, Code 109
22 IC50
  • Mast/stem cell growth factor receptor Kit
  • Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
  • Platelet-derived growth factor receptor alpha
  • Proto-oncogene tyrosine-protein kinase Src
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • Tyrosine-protein kinase ABL1
  • Tyrosine-protein kinase Blk
  • Tyrosine-protein kinase FRK
  • Tyrosine-protein kinase Fgr
  • Tyrosine-protein kinase Fyn
  • Tyrosine-protein kinase HCK
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase Lyn
  • Tyrosine-protein kinase Yes
  • CHEMBL3823849
  • US10294227, Code 112
22 IC50
  • Mast/stem cell growth factor receptor Kit
  • Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
  • Platelet-derived growth factor receptor alpha
  • Proto-oncogene tyrosine-protein kinase Src
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • Tyrosine-protein kinase ABL1
  • Tyrosine-protein kinase Blk
  • Tyrosine-protein kinase FRK
  • Tyrosine-protein kinase Fgr
  • Tyrosine-protein kinase Fyn
  • Tyrosine-protein kinase HCK
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase Lyn
  • Tyrosine-protein kinase Yes
  • CHEMBL3822591
  • US10294227, Code 113
22 Ki
  • Beta-chymotrypsin
  • Chymase
  • Granzyme K
  • Plasma kallikrein
  • Plasminogen
  • Prothrombin
  • Tryptase
  • Tryptase alpha/beta-1
  • Tryptase beta-1/beta-2
  • Urokinase-type plasminogen activator
  • Vitamin K-dependent protein C
  • (S)-ethyl 1-(5-(4-phenethoxybenzyl)-1,2,4-oxadiazol-3-yl)-6-amino-1-oxohexan-2-ylcarbamate
  • CHEMBL211561
22 IC50
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • 1-(2-(2-chlorophenyl)-1-phenylethyl)piperazine
  • CHEMBL213287
  • CHEMBL534942
21 IC50 1 Kd
  • 1,3-beta-glucan synthase component GLS2
  • Cathepsin B
  • Cathepsin D
  • Cathepsin E
  • Cathepsin G
  • Cathepsin K
  • Cathepsin S
  • Cathepsin Z
  • Dipeptidyl peptidase 1
  • Dipeptidyl peptidase I
  • Pro-cathepsin H
  • Procathepsin L
  • CHEMBL3900409
  • US10287258, Example 2
  • US10669245, Example 2
22 IC50
  • 72 kDa type IV collagenase
  • ADAM17
  • Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10)
  • Disintegrin and metalloproteinase domain-containing protein 17
  • Disintegrin and metalloproteinase domain-containing protein 33
  • Disintegrin and metalloproteinase domain-containing protein 8
  • Disintegrin and metalloproteinase domain-containing protein 9 (ADAM9)
  • Interstitial collagenase
  • Matrix metalloproteinase-12 (MMP12)
  • Matrix metalloproteinase-14 (MMP14)
  • Matrix metalloproteinase-7 (MMP7)
  • Matrix metalloproteinase-9
  • Receptor tyrosine-protein kinase erbB-2
  • Stromelysin-1
  • (6S,7S)-methyl 7-(hydroxycarbamoyl)-6-(4-phenyl-1,2,3,6-tetrahydropyridine-1-carbonyl)-5-azaspiro[2.5]octane-5-carboxylate
  • CHEMBL434567
  • methyl (6S,7S)-7-[(hydroxyamino)carbonyl]-6-[(4-phenyl-3,6-dihydropyridin-1(2H)-yl)carbonyl]-5-azaspiro[2.5]octane-5-carboxylate
22 IC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1B
  • 5-hydroxytryptamine receptor 1D
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 4 (5-HT4)
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Adenosine receptor A2a
  • Adrenergic receptor alpha-1
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor
  • C-X-C chemokine receptor type 1
  • C-X-C chemokine receptor type 2
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Histamine H1 receptor
  • Histamine H3 receptor
  • Mitogen-activated protein kinase 14
  • Plasminogen activator inhibitor-1
  • Purinergic receptor P2Y1
  • 7-nitro-1,1-dioxo-3-(2-phenoxy-phenylamino)-1,4-dihydro-1lambda6-benzo[1,2,4]thiadiazin-5-ol
  • CHEMBL399203
15 Ki 7 IC50
  • Aurora kinase A/Targeting protein for Xklp2
  • Aurora kinase B
  • Axin-1/Glycogen synthase kinase-3 beta
  • CDK2/CycE
  • CDK7/Cyclin H/MNAT1
  • Cyclin-Dependent Kinase 1 (CDK1)
  • Cyclin-Dependent Kinase 2 (CDK2)
  • Cyclin-Dependent Kinase 4 (CDK4)
  • Cyclin-Dependent Kinase 5 (CDK5)
  • Cyclin-Dependent Kinase 7 (CDK7)
  • Cyclin-Dependent Kinase 9 (CDK9)
  • Cyclin-dependent kinase 1
  • Cyclin-dependent kinase 2
  • Cyclin-dependent kinase 4
  • Cyclin-dependent kinase 7
  • Cyclin-dependent kinase 9
  • Tyrosine-protein kinase ABL1
  • (4-(2-Amino-4-methylthiazol-5-yl)pyrimidin-2-yl)-(3-nitrophenyl)amine
  • 4-methyl-5-(2-(3-nitrophenylamino)pyrimidin-4-yl)thiazol-2-amine
  • CHEMBL298445
  • [4-(2-AMINO-4-METHYL-THIAZOL-5-YL)-PYRIMIDIN-2-YL]-(3-NITRO-PHENYL)-AMINE
22 IC50
  • ITGA5/ITGB1
  • ITGAV/ITGB3
  • ITGAV/ITGB5
  • Integrin alpha-IIb/beta-3
  • CHEMBL411941
  • CycloRGDfV
  • [(2S,5R,8S,11S)-5-Benzyl-11-(3-guanidino-propyl)-8-isopropyl-3,6,9,12,15-pentaoxo-1,4,7,10,13pentaaza-cyclopentadec-2-yl]-acetic acid
  • [5-Benzyl-11-(3-guanidino-propyl)-8-isopropyl-3,6,9,12,15-pentaoxo-1,4,7,10,13pentaaza-cyclopentadec-2-yl]-acetic acid(Cyclo (RGDfV))
  • c(RGDfV)
  • c-[-Arg-Gly-Asp-fV-]
  • c[Arg-Gly-Asp-(R)-Phe-Val]
  • cyclo(Arg-Gly-Asp-D-Phe-Val)
10 Ki 11 IC50 1 Kd
  • Acetylcholinesterase
  • Acetylcholinesterase and butyrylcholinesterase (AChE and BChE)
  • Anandamide amidohydrolase
  • Cannabinoid receptor 1
  • Carbonic Anhydrase XIII
  • Carbonic anhydrase 1
  • Carbonic anhydrase 2
  • Carboxylic ester hydrolase
  • Cholinesterases
  • Monoglyceride Lipase (MGL)
  • Muscarinic acetylcholine receptor DM1
  • CHEMBL23838
  • O,O-diethyl O-p-nitrophenyl phosphate
  • diethyl 4-nitrophenyl phosphate
  • diethyl p-nitrophenyl phosphate
  • diethyl paraoxon
  • ethyl paraoxon
  • p-nitrophenyl diethyl phosphate
  • paraoxon
  • phosphacol
  • phosphoric acid diethyl 4-nitrophenyl ester
8 Ki 12 IC50 2 Kd
  • 10 kDa chaperonin
  • 60 kDa chaperonin
  • AGTR1
  • Angiotensin II AT1B
  • Angiotensin II AT2
  • Angiotensin II receptor
  • Angiotensin II type 1a (AT-1a) receptor
  • HSP60/HSP10
  • Thiosulfate sulfurtransferase
  • 2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid(CV-11974)
  • 2-Ethoxy-3-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid
  • 2-ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid
  • CANDESARTAN
  • CHEMBL1016
  • CV-11974
3 Ki 16 IC50 3 Kd
  • 5-lipoxygenase/FLAP
  • Arachidonate 5-lipoxygenase
  • BDNF/NT-3 growth factors receptor
  • Cyclooxygenase
  • High affinity nerve growth factor receptor
  • Indoleamine 2,3-dioxygenase
  • Indoleamine 2,3-dioxygenase 2
  • Mitogen-activated protein kinase 8
  • Tryptophan 2,3-dioxygenase
  • CHEMBL306946
  • GNF-PF-2691
  • Indolo[2,1-b]quinazoline-6,12-dione
  • TCMDC-125859
  • TRYPTANTHRIN
  • US10669273, Compound 5a
22 IC50
  • Cereblon/Histone deacetylase 1
  • Cereblon/Histone deacetylase 2
  • Cereblon/Histone deacetylase 6
  • Histone deacetylase
  • Histone deacetylase 1
  • Histone deacetylase 10
  • Histone deacetylase 3
  • Histone deacetylase 8
  • Nuclear receptor corepressor 1
  • Potassium voltage-gated channel subfamily H member 2
  • CHEMBL4087968
22 Kd
  • Galectin-1
  • Galectin-2
  • Galectin-3
  • Galectin-4
  • Galectin-7
  • Galectin-8
  • Galectin-9
  • PA-I galactophilic lectin
  • CHEMBL442951
  • methyl beta-D-galactopyranoside
  • methyl beta-D-galactoside
2 Ki 18 IC50 2 EC50
  • Cytoplasmic tyrosine-protein kinase BMX
  • Epidermal growth factor receptor
  • Nuclear receptor subfamily 2 group C member 2 (TAK1)
  • Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
  • Tyrosine-protein kinase BTK
  • Tyrosine-protein kinase Blk
  • Tyrosine-protein kinase JAK3
  • Tyrosine-protein kinase TEC
  • CHEMBL4077064
  • US10000483, Compound II-4
20 Ki 2 IC50
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 2B
  • Adrenergic receptor
  • Alpha-1A adrenergic receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Histamine H1 receptor
  • Histamine H2 receptor
  • Histamine H3 receptor
  • Monoamine transporter
  • Muscarinic acetylcholine receptor M1 and M3
  • Muscarinic acetylcholine receptor M2 and M4
  • Muscarinic acetylcholine receptor M2 and M5
  • Neuronal acetylcholine receptor; alpha3/beta4
  • Sodium-dependent serotonin transporter
  • CHEMBL4084262
3 Ki 19 IC50
  • Cathepsin B
  • Cathepsin F
  • Cathepsin K
  • Cathepsin L2
  • Cathepsin S
  • Cathepsin Z
  • Cruzipain
  • Dipeptidyl peptidase I
  • Pro-cathepsin H
  • Procathepsin L
  • CHEMBL481611
  • MK-0822
  • Odanacatib
22 Ki
  • Cathepsin G
  • Coagulation factor X
  • Coagulation factor XI
  • Coagulation factor XII
  • Complement C1s
  • Granzyme B
  • Hepatocyte growth factor activator/Serine protease hepsin/Suppressor of tumorigenicity 14 protein
  • Kallikrein 1
  • Kallikrein 14
  • Kallikrein 2
  • Kallikrein 5
  • Kallikrein 6
  • Kallikrein-12
  • Kallikrein-13
  • Plasma kallikrein
  • Plasminogen
  • Prothrombin
  • Thrombin and coagulation factor VII
  • Vitamin K-dependent protein C
  • CHEMBL4070056
22 IC50
  • 3',5'-cyclic phosphodiesterase
  • Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A
  • Homo sapiens phosphodiesterase 2A (PDE2A)
  • Phosphodiesterase 11A
  • Phosphodiesterase 8
  • Rod cGMP-specific 3',5'-cyclic phosphodiesterase alpha/beta
  • cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
  • cAMP-specific 3',5'-cyclic phosphodiesterase 4D
  • cAMP-specific 3',5'-cyclic phosphodiesterase 7B
  • CHEMBL4064344
17 Ki 5 IC50
  • Bromodomain and extra-terminal motif (BET)
  • Bromodomain-containing protein 4
  • Bromodomain-containing protein 9
  • CREB-binding protein
  • HIF1A/p300/CREB-binding protein
  • Transcription initiation factor TFIID subunit 1
  • Transcription initiation factor TFIID subunit 1-like
  • CHEMBL4078100
10 Ki 12 IC50
  • 72 kDa type IV collagenase
  • Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10)
  • Disintegrin and metalloproteinase domain-containing protein 17
  • Disintegrin and metalloproteinase domain-containing protein 33
  • Disintegrin and metalloproteinase domain-containing protein 9 (ADAM9)
  • Interstitial collagenase
  • Matrix metalloproteinase (2 and 3)
  • Matrix metalloproteinase 12
  • Matrix metalloproteinase 14
  • Matrix metalloproteinase 15
  • Matrix metalloproteinase 7
  • Matrix metalloproteinase-12 (MMP12)
  • Matrix metalloproteinase-14 (MMP14)
  • Matrix metalloproteinase-7 (MMP7)
  • Matrix metalloproteinase-9
  • Neutrophil collagenase
  • Stromelysin-1
  • (6S,7S)-N-hydroxy-5-methyl-6-(4-(5-(trifluoromethyl)pyridin-2-yl)piperazine-1-carbonyl)-5-azaspiro[2.5]octane-7-carboxamide
  • CHEMBL497985
21 IC50 1 EC50
  • Bromodomain adjacent to zinc finger domain protein 2B
  • Bromodomain-containing protein 4
  • Bromodomain-containing protein 8
  • Bromodomain-containing protein 9
  • CREB-binding protein
  • Cat eye syndrome critical region protein 2
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6
  • Cytochrome P450 3A
  • Histone acetyltransferase KAT2A/KAT2B
  • Histone acetyltransferase p300/Hypoxia-inducible factor 1-alpha
  • Nucleosome-remodeling factor subunit BPTF
  • Peregrin
  • Transcription initiation factor TFIID subunit 1
  • CHEMBL4097025
22 IC50
  • Neuraminidase
  • CHEMBL4125754
22 IC50
  • Neuraminidase
  • CHEMBL4126987
22 IC50
  • Neuraminidase
  • CHEMBL4125895
22 IC50
  • Neuraminidase
  • CHEMBL4127125
22 IC50
  • Neuraminidase
  • CHEMBL4128362
8 Ki 14 IC50
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Multidrug resistance-associated protein 4
  • SSTR2
  • SSTR3
  • SSTR5
  • Somatostatin receptor type 1
  • Somatostatin receptor type 2
  • Somatostatin receptor type 3
  • Somatostatin receptor type 4
  • Somatostatin receptor type 5
  • 10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-benzyl-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carboxylic acid (2-hydroxy-1-
  • 10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-benzyl-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carboxylic acid (2-hydroxy-1-hydroxymethyl-propyl)-amide
  • 2-{[(13R,16S,19R)-10-(4-Amino-butyl)-19-((S)-2-amino-3-phenyl-propionylamino)-16-benzyl-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carbonyl]-amino}-3-hydroxy-butyric acid
  • CHEMBL1680
  • OCTREOTIDE
1 Ki 10 IC50 11 EC50
  • Cytochrome P450 1A
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6
  • Cytochrome P450 3A
  • Metabotropic glutamate receptor
  • Metabotropic glutamate receptor 2
  • Metabotropic glutamate receptor 3
  • Metabotropic glutamate receptor 4
  • Metabotropic glutamate receptor 6
  • Metabotropic glutamate receptor 7 (mGlu7)
  • Neurokinin 1 receptor
  • CHEMBL4160748
22 IC50
  • ALK5
  • Activin receptor type-1B
  • Mitogen-activated protein kinase 14
  • Serine/threonine-protein kinase RIPK2
  • TGF-beta receptor type-1
  • Vascular endothelial growth factor receptor 2
  • 2-(4-(benzo[d][1,3]dioxol-5-yl)-2-tert-butyl-1H-imidazol-5-yl)-6-methylpyridine
  • 2-(5-(benzo[d][1,3]dioxol-5-yl)-2-tert-butyl-1H-imidazol-4-yl)-6-methylpyridine
  • CHEMBL1824446
  • CHEMBL226838
  • SB-505124
21 IC50 1 Kd
  • ATP-binding cassette sub-family G member 2
  • BDNF/NT-3 growth factors receptor
  • CDK2/Cyclin E/G1/S-specific cyclin E2
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Ephrin type-A receptor 2 (EPHA2)
  • High affinity nerve growth factor receptor
  • Insulin receptor
  • Insulin-like growth factor 1 receptor
  • Insulin-like growth factor I receptor
  • Multidrug resistance protein 1/Multidrug resistance associated protein 1
  • Potassium voltage-gated channel subfamily H member 2
  • RAC-alpha serine/threonine-protein kinase
  • Serine/threonine-protein kinase LMTK3
  • (S)-1-(4-(5-cyclopropyl-1H-pyrazol-3-ylamino)pyrrolo[1,2-f][1,2,4]triazin-2-yl)-N-(6-fluoropyridin-3-yl)-2-methylpyrrolidine-2-carboxamide
  • 1-{4-[(3-cyclopropyl-1H-pyrazol-5-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl}-N-(6-fluoropyridin-3-yl)-2-methyl-L-prolinamide
  • BMS-754807
  • CHEMBL575448
13 IC50 9 Kd
  • DNA-dependent protein kinase
  • Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
  • Phosphatidylinositol 3-kinase catalytic subunit type 3
  • Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
  • Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
  • Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
  • Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
  • Phosphatidylinositol 4-kinase beta
  • Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta
  • mTOR/FKBP12A/FKBP12B
  • 1-(4-{[4-(Dimethylamino)piperidin-1-yl]carbonyl}phenyl)-3-[4-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)phenyl]urea
  • CHEMBL592445
  • PKI-587
22 IC50
  • Aurora kinase B
  • CDK2/Cyclin A/Cyclin A1
  • Casein kinase I
  • Cyclin-Dependent Kinase 1 (CDK1)
  • MAP kinase-activated protein kinase 2
  • Mitogen-activated protein kinase 1
  • Mitogen-activated protein kinase 14
  • Mitogen-activated protein kinase kinase kinase kinase 2
  • PKC alpha and beta-2
  • Platelet-derived growth factor receptor alpha
  • Protein kinase C (PKC)
  • Protein kinase C delta type
  • Protein kinase C theta type
  • Protein kinase C, epsilon
  • Protein kinase C, eta
  • Proto-oncogene tyrosine-protein kinase Src
  • Rho-associated protein kinase 1
  • Ribosomal protein S6 kinase alpha 1
  • Serine/threonine-protein kinase Chk1/2
  • Tyrosine-protein kinase Fyn
  • Tyrosine-protein kinase HCK
  • Tyrosine-protein kinase Lyn
  • 4-(4-methyl-1H-indol-5-ylamino)-5-(3-(4-methylpiperazin-1-ylsulfonyl)styryl)nicotinonitrile
  • CHEMBL1080994
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