Compound Name
(alphabetical) | Enz. Inhib. Data | ITC Data | Binding Targets | Alternate Compound Names |
|---|
| Ki | IC50 | Kd | EC50 | Koff | Kon | Other |
|---|
BDBM16314
 | 2 | 42 | 0 | 0 | 0 | 0 | 0 | 0 | - Aldehyde reductase
- Aldo-keto reductase family 1 member C21
- Aldo-keto reductase family member 1B10 (AKR1B10)
- Aldose reductase
- Aldose reductase (ALR2)
- Aldose reductase (AR)
- Bile salt export pump
| - 2-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]-N-methylmethanethioamido}acetic acid
- Alredase
- CHEMBL436
- N-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonothioyl}-N-methylglycine
- Tolrestat
|
BDBM18137
 | 11 | 16 | 5 | 11 | 1 | 1 | 0 | 0 | - 2'-deoxynucleoside 5'-phosphate N-hydrolase 1
- 5'-AMP-activated protein kinase Complex 1
- ADORA3
- AMPK alpha2/beta1/gamma1
- Adenosine Receptors A2a (A2a)
- Adenosine receptor A1
- Adenylate kinase 1
- Adenylate kinase 2
- Axin-1/Glycogen synthase kinase-3 beta
- Cholecystokinin
- Deoxyribonucleoside 5'-monophosphate N-glycosidase (Rcl)
- Fructose-1,6-bisphosphatase
- Fructose-1,6-bisphosphatase 1 (FBPase)
- Human immunodeficiency virus type 1 protease
- Inosine-5'-monophosphate dehydrogenase
- Ketopantoate reductase
- Mitogen-activated protein kinase kinase kinase 7
- P2Y purinoceptor 1
- Phospholipase C, gamma 1
- Phospholipase C-beta-3
- Proto-oncogene tyrosine-protein kinase Src
- Purinergic receptor P2Y1
- Purinergic receptor P2Y11
- Purinergic receptor P2Y2
- Transient receptor potential cation channel subfamily M member 2
- tRNA synthetase (GlyRS)
| - AMP
- CHEMBL752
- [(2R,3S,4R,5R)-5-adenin-9-yl-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate;hydrate
- adenosine 5 -monophosphate
- {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
|
BDBM199181
 | 0 | 45 | 0 | 0 | 0 | 0 | 0 | 0 | - Human diphtheria toxin-like ADP-ribosyltransferase (ARTD10 or PARP10)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD12 or PARP12)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD15 or PARP16)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD3 or PARP3)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD4 or PARP4)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD5 or PARP5a)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD6 or PARP5b)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD7 or PARP15)
- Human diphtheria toxin-like ADP-ribosyltransferase (ARTD8 or PARP14)
- Human diphtheria toxin-like ADP-ribosyltransferase (L928Y) (ARTD10 or PARP10(L928Y))
- Human diphtheria toxin-like ADP-ribosyltransferase (R931A) (ARTD10 or PARP10(R931A)
- Human diphtheria toxin-like ADP-ribosyltransferase (S927A) (ARTD10 or PARP10(S927A))
- Human diphtheria toxin-like ADP-ribosyltransferase (Y1660L) (ARTD8 or PARP14(Y1660L))
- Human diphtheria toxin-like ADP-ribosyltransferase (Y598L) (ARTD7 or PARP15 (Y598L))
- Mono [ADP-ribose] polymerase PARP16
- Poly [ADP-ribose] polymerase 1
- Poly [ADP-ribose] polymerase 10
- Poly [ADP-ribose] polymerase 11
- Poly [ADP-ribose] polymerase 12
- Poly [ADP-ribose] polymerase 14
- Poly [ADP-ribose] polymerase 15
- Poly [ADP-ribose] polymerase 2
- Poly [ADP-ribose] polymerase 4
- Poly [ADP-ribose] polymerase tankyrase-1
- Poly [ADP-ribose] polymerase tankyrase-2
- Protein mono-ADP-ribosyltransferase PARP3
| - 4-[(4-Carbamoylcyclohexyl)oxy]cyclohexane-1-carboxamide (OUL35)
|
BDBM21674
 | 0 | 3 | 0 | 42 | 0 | 0 | 0 | 0 | - Bile acid receptor
- Bile acid receptor FXR
- Bile salt export pump
- G-protein coupled bile acid receptor 1
- Vitamin D3 receptor
| - (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid
- CDCA
- CHENODIOL
- Chenodeoxycholic Acid
- US10208081, CDCA
|
BDBM22567
 | 25 | 16 | 3 | 1 | 0 | 0 | 0 | 0 | - 5-hydroxytryptamine receptor 1A
- Bile salt export pump
- HRH3
- Histamine H1 receptor
- Histamine H3 receptor
- Histamine H4 receptor
- Potassium voltage-gated channel subfamily H member 2
| - 3H]pyrilamine
- CHEMBL511
- Dorantamin
- MEPYRAMINE
- Mepyramine
- N-(4-methoxybenzyl)-N ,N -dimethyl-N-pyridin-2-ylethane-1,2-diamine
- N-[2-(dimethylamino)ethyl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
- PYRILAMINE
- Pyranisamine
- [3H]mepyramine
- [3H]pyrilamine
|
BDBM23420
 | 8 | 35 | 1 | 0 | 0 | 0 | 0 | 0 | - 12-Lipoxygenase (12-LOX)
- 3C-like proteinase (3CL-PRO)
- Aldehyde dehydrogenase, mitochondrial
- Aldo-keto reductase family member 1B10 (AKR1B10)
- Aldose reductase
- Alpha-amylase
- Alpha-glucosidase MAL62
- Arachidonate 15-lipoxygenase
- Beta-glucuronidase
- Beta-glucuronidase (EcGUS)
- Calcium channel
- Carbonic anhydrase 1
- Carbonic anhydrase 12
- Carbonic anhydrase 2
- Carbonic anhydrase 4
- Carbonic anhydrase 7
- Cytochrome P450 19A1
- Epidermal growth factor receptor
- Estradiol receptor beta (ERβ)
- Estrogen receptor
- Estrogen receptor beta
- Fatty acid synthase
- Neuraminidase
- Proteasome subunit beta type-1/beta type-5
- Tyrosinase
- Urease subunit beta
- Uridine-5'-diphosphoglucuronosyltransferase 1A1
- Xanthine dehydrogenase/oxidase
| - 7,4′-Dihydroxy-isoflavone (3a)
- 7-hydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one
- CHEMBL8145
- Daidzein
- US8552057, 7
|
BDBM26983
 | 43 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | - Alpha carbonic anhydrase
- Astrosclerin-3
- Carbonic Anhydrase VA
- Carbonic Anhydrase XIII
- Carbonic Anhydrase XV
- Carbonic anhydrase
- Carbonic anhydrase 1
- Carbonic anhydrase 2
- Carbonic anhydrase 4
- Carbonic anhydrase 6 (CA-VI)
- Carbonic anhydrase 7
- Carbonic anhydrase 9
- Gamma-carbonic anhydrase
| - CHEMBL1644028
- SCN(-1)
- Thiocyanate
- cyanosulfanide
- sodium thiocyanate
- thiocyanate
|
BDBM31044
 | 0 | 38 | 2 | 5 | 0 | 0 | 0 | 0 | - 5-hydroxytryptamine receptor 1A
- Cathepsin B
- Cathepsin S
- Dual Specificity Protein Phosphatase 1
- Dual specificity phosphatase Cdc25B
- Heat shock factor protein 1
- Heat shock protein HSP 90-alpha
- Heat shock protein HSP 90-beta
- Lipoamide Dehydrogenase (Lpd)
- MKP-3
- Nuclear receptor ROR-alpha
- Procathepsin L
- Pyruvate dehydrogenase (PDH)
- Serotonin (5-HT) receptor
- Sphingosine 1-phosphate receptor 1
- Sphingosine 1-phosphate receptor 3
- Steroidogenic Factor 1
- diphosphomevalonate decarboxylase
- mevalonate kinase
| - 1-Ethyl-6-methyl-3-thiophen-2-yl-1H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
- 1-ethyl-6-methyl-3-(2-thienyl)pyrimido[5,4-e][1,2,4]triazine-5,7-quinone
- 1-ethyl-6-methyl-3-thiophen-2-yl-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
- 1-ethyl-6-methyl-3-thiophen-2-ylpyrimido[5,4-e][1,2,4]triazine-5,7-dione
- MLS000033110
- SMR000008918
- US9073941, 610
- cid_653297
|
BDBM50014406
 | 42 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | - 5-HT3A Serotonin Receptor
- 5-HT5
- 5-hydroxytryptamine receptor 1A
- 5-hydroxytryptamine receptor 1B
- 5-hydroxytryptamine receptor 1D
- 5-hydroxytryptamine receptor 2A
- 5-hydroxytryptamine receptor 2B
- 5-hydroxytryptamine receptor 2B (5HT2B)
- 5-hydroxytryptamine receptor 2C
- 5-hydroxytryptamine receptor 3A
- 5-hydroxytryptamine receptor 5A
- 5-hydroxytryptamine receptor 6
- 5-hydroxytryptamine receptor 7
- D(1A) dopamine receptor
- D(2) dopamine receptor
- HTR1D
- HTR6
- HTR7
- Serotonin (5-HT) receptor
- Serotonin 1B/1D receptor
- Serotonin 2 (5-HT2) receptor
- Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor
- Serotonin receptor 2a and 2b (5HT2A and 5HT2B)
- Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
| - 2-Me 5-HT
- 2-Methyl-5-hydroxytryptamine
- 2-methyl-5-HT
- 2-methylserotonin
- 3-(2-aminoethyl)-2-methyl-1H-indol-5-ol
- 5-HT,2-Me
- CHEMBL266591
|
BDBM50032219
 | 5 | 8 | 4 | 28 | 0 | 0 | 0 | 0 | - Cytochrome CYP26A1
- Cytochrome P450 3A
- Nuclear receptor ROR-gamma (RORC)
- Retinoic acid receptor RXR-alpha
- Retinoic acid receptor RXR-alpha/Retinoic acid receptor beta
- Retinoic acid receptor RXR-alpha/gamma
- Retinoic acid receptor alpha/Retinoid X receptor alpha
- Retinoid X receptor gamma/retinoic acid receptor alpha
- Retinoid receptor
| - (E)-4-(2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-enyl)benzoic acid
- 4-(2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-enyl)benzoic acid
- 4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID
- 4-[(E)-2-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-propenyl]-benzoic acid
- 4-[(E)-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl]benzoic acid
- 4-[2-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-propenyl]-benzoic acid
- CHEMBL275311
- US9963439, TTNPB
|
BDBM50050513
 | 10 | 35 | 0 | 0 | 0 | 0 | 0 | 0 | - Acyl-protein thioesterase 1/2
- Dipeptidyl peptidase 2 (DPP II)
- Dipeptidyl peptidase 4
- Dipeptidyl peptidase 9
- Dipeptidyl peptidase VIII
- Fibroblast activation protein (FAP)
- Fibroblast activation protein alpha
- Prolyl endopeptidase
| - (R)-1-((S)-2-amino-3-methylbutanoyl)pyrrolidin-2-ylboronic acid
- (S)-2-Amino-1-((R)-2-dihydroxyboron-pyrrolidin-1-yl)-3-methyl-butan-1-one
- (S)-2-Amino-3-methyl-2-boronic acid-1-pyrrolidin-1-yl-butan-1-one
- Boronic acid derivative
- CHEMBL67279
- Ketopyrrolidine derivative
- Pyrrolidine derivative
|
BDBM50060964
 | 35 | 4 | 4 | 2 | 0 | 0 | 0 | 0 | - 5-hydroxytryptamine receptor 1A
- 5-hydroxytryptamine receptor 7
- ADRA1B
- Adrenergic alpha1B
- Adrenergic receptor alpha-2
- Alpha adrenergic receptor 1A and 1B
- Alpha-1 adrenergic receptor
- Alpha-1A adrenergic receptor
- Alpha-1D adrenergic receptor
- Alpha-2A adrenergic receptor
- Alpha-2C adrenergic receptor
- Cerebral cortex alpha adrenergic receptor
- D(2) dopamine receptor
- D(3) dopamine receptor
| - (R)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide
- 5-[(2R)-2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl]-2-methoxybenzenesulfonamide
- 5-[2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxy-benzenesulfonamide
- CHEMBL836
- TAMSULOSIN
|
BDBM50061101
 | 8 | 34 | 0 | 3 | 0 | 0 | 0 | 0 | - Bile acid transporter
- Bile salt export pump
- Bile salt export pump (BSEP)
- Canalicular multispecific organic anion transporter 2
- EDNRA
- EDNRB
- Endothelin receptor ET-A
- Endothelin receptor, ET-A/ET-B
- Endothelin-1 receptor
- Multidrug resistance-associated protein 4
- Nuclear receptor subfamily 1 group I member 2
| - 4-(1,1-Dimethylethyl)-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-(2,2'-bipyrimidin)-4-yl) benzenesulfornamide
- 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2,2'-bipyrimidin-4-yl]benzenesulfonamide
- BOSENTAN
- CHEMBL957
- p-tert-Butyl-N-(6-(2-hydroxyethoxy)-5-(o-methoxyphenoxy)-2-(2-pyrimidinyl)-4-pyrimidinyl)benzenesulfonamide
|
BDBM50090677
 | 2 | 43 | 0 | 0 | 0 | 0 | 0 | 0 | - Cytochrome P450 2C18
- Cytochrome P450 2C19
- Cytochrome P450 2C8
- Cytochrome P450 2C9
- Cytochrome P450 2J2
- Sterol 14α-demethylase (CYP51)
- Uridine-5'-diphosphoglucuronosyltransferase 1A1
- Uridine-5'-diphosphoglucuronosyltransferase 1A4
- Uridine-5'-diphosphoglucuronosyltransferase 1A6
- Uridine-5'-diphosphoglucuronosyltransferase 2B10
- Uridine-5'-diphosphoglucuronosyltransferase 2B7
| - 4-Amino-N-(2-phenyl-2H-pyrazol-3-yl)-benzenesulfonamide
- 4-amino-N-(1-phenyl-1H-pyrazol-5-yl)benzenesulfonamide
- CHEMBL1109
- SULFAPHENAZOLE
- Sulfabid
- Sulphaphenazole
- US9180183, Sulfaphenazole
|
BDBM50099491
 | 1 | 5 | 5 | 33 | 0 | 0 | 0 | 0 | - Bile acid receptor
- Homo sapiens huntingtin (HTT), mRNA
- Intestinal fatty acid-binding protein (hIFABP)
- Peroxisome proliferator-activated receptor
- Peroxisome proliferator-activated receptor alpha
- Peroxisome proliferator-activated receptor alpha (PPAR alpha)
- Peroxisome proliferator-activated receptor delta
- Peroxisome proliferator-activated receptor gamma
- Pre-mRNA-processing factor 19
- Ubiquitin carboxyl-terminal hydrolase 1
- Ubiquitin carboxyl-terminal hydrolase 1/WD repeat-containing protein 48
| - 2-(4-(2-(3-cyclohexyl-1-(4-cyclohexylbutyl)ureido)ethyl)phenylthio)-2-methylpropanoic acid
- 2-(4-{2-[3-Cyclohexyl-1-(4-cyclohexyl-butyl)-ureido]-ethyl}-phenylsulfanyl)-2-methyl-propionic acid
- CHEMBL21241
- GW7647
- cid_3392731
|
BDBM50101817
 | 6 | 38 | 0 | 1 | 0 | 0 | 0 | 0 | - Acetylcholinesterase
- Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
- Bile salt export pump
- Bile salt export pump (BSEP)
- Calcium channel (Type L)
- Canalicular multispecific organic anion transporter 1
- Canalicular multispecific organic anion transporter 2
- Cholinesterase
- Cytochrome P450 1A
- Cytochrome P450 2C19
- Cytochrome P450 2C9
- Cytochrome P450 2D6 (2D6)
- Cytochrome P450 2J2
- Cytochrome P450 3A
- Multidrug resistance protein 1/Multidrug resistance associated protein 1
- Multidrug resistance-associated protein 4
- Myosin light chain kinase, smooth muscle
- Potassium channel subfamily K member 2
- Sodium channel protein type I I alpha subunit
- Twik-RElated Potassium (K+) channel 1 (TREK1)
- Voltage-dependent L-type calcium channel subunit alpha-1C
- Voltage-dependent L-type calcium channel subunit alpha-1F
- Voltage-dependent L-type calcium channel subunit alpha-1S
- Voltage-gated L-type calcium channel
- Voltage-gated potassium channel subfamily A member 1/beta-1
| - Adalat
- Adalat Cc
- Afeditab Cr
- BAY-A-1040
- CHEBI:7565
- NIFEDIPINE
- Nifedipine
- Procardia
- Procardia Xl
|
BDBM50108392
 | 30 | 8 | 3 | 4 | 0 | 0 | 0 | 0 | - 5-HT3A Serotonin Receptor
- 5-hydroxytryptamine receptor 1A
- 5-hydroxytryptamine receptor 3A
- Acetylcholine receptor protein alpha chain/beta chain/delta chain /gamma chain
- Cholinergic, Nicotinic Alpha3Beta2
- D(2) dopamine receptor
- HTR3A
- HTR4
- Neuronal acetylcholine receptor
- Neuronal acetylcholine receptor Alpha-4/Beta-2
- Neuronal acetylcholine receptor protein alpha-7 subunit
- Neuronal acetylcholine receptor; alpha3/beta4
- Serotonin 1 (5-HT1) receptor
- Serotonin 3 receptor (5HT3)
- Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor
- Serotonin 3a (5-HT3a)/3b (5-HT3b)/3c (5-HT3c)/3d (5-HT3d)/3e (5-HT3e) receptor
| - (3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL 1H-INDOLE-3-CARBOXYLATE
- CHEMBL56564
|
BDBM50163864
 | 0 | 0 | 33 | 0 | 6 | 6 | 0 | 0 | - Carbonic anhydrase
- Carbonic anhydrase 1
- Carbonic anhydrase 12
- Carbonic anhydrase 13 (CA XIII)
- Carbonic anhydrase 2
- Carbonic anhydrase 7
- Carbonic anhydrase 9
- Carbonic anhydrases; II & IX
| - 3-(1H-benzimidazol-1-ylacetyl)benzenesulfonamide (3a)
- CHEMBL3799296
- carbonic anhydrase (CA) inhibitors, benzenesulphonamide ligand, 3
|
BDBM50169959
 | 0 | 45 | 0 | 0 | 0 | 0 | 0 | 0 | - 3-phosphoinositide dependent protein kinase-1
- Axin-1/Glycogen synthase kinase-3 beta
- CDK2/Cyclin A/Cyclin A1
- Dual specificity mitogen-activated protein kinase kinase 1
- Dual specificity mitogen-activated protein kinase kinase 4
- Dual specificity mitogen-activated protein kinase kinase 6
- Dual specificity mitogen-activated protein kinase kinase 7 (MAP2K7)
- Dual-specificity tyrosine-phosphorylation regulated kinase 2
- Epidermal growth factor receptor
- Inhibitor of nuclear factor kappa-B kinase subunit beta
- MAP kinase-activated protein kinase 2
- MAP kinase-activated protein kinase 5
- Mitogen-activated protein kinase 10
- Mitogen-activated protein kinase 14
- Mitogen-activated protein kinase 3
- Mitogen-activated protein kinase 8
- Mitogen-activated protein kinase 9
- Protein kinase C alpha type
- Proto-oncogene tyrosine-protein kinase Src
- RAC-alpha serine/threonine-protein kinase
- RAF proto-oncogene serine/threonine-protein kinase
- Rho-associated protein kinase 2
- Ribosomal protein S6 kinase 2/S6K1
- Ribosomal protein S6 kinase alpha 5
- Ribosomal protein S6 kinase alpha-3
- Serine/threonine-protein kinase Chk1/2
- Serine/threonine-protein kinase Sgk1
- Serine/threonine-protein kinase pim-1
- Serine/threonine-protein kinase pim-3
- Tyrosine-protein kinase Blk
- c-Jun N-terminal kinase 3
| - 2-(benzo[d]thiazol-2(3H)-ylidene)-2-(2-(2-(pyridin-3-yl)ethylamino)pyrimidin-4-yl)acetonitrile
- AS-601245
- AS601245
- CHEMBL1788116
- CHEMBL191384
- [3H-Benzothiazol-(2Z)-ylidene]-[2-(2-pyridin-3-yl-ethylamino)-pyrimidin-4-yl]-acetonitrile
|
BDBM50228403
 | 0 | 43 | 2 | 0 | 0 | 0 | 0 | 0 | - Dipeptidyl peptidase 2 (DPP II)
- Dipeptidyl peptidase 4
- Dipeptidyl peptidase 8/9
- Dipeptidyl peptidase 9
- Dipeptidyl peptidase II and dipeptidyl peptidase IV (DPP2 and DPP4)
- Dipeptidyl peptidase IV
- Dipeptidyl peptidase VIII
- Dipeptidyl peptidase-IV (DDP-4)
- Fibroblast activation protein (FAP)
- Fibroblast activation protein alpha
- Lysosomal phospholipase A1
- Muscarinic acetylcholine receptor M1
- POU domain, class 2, transcription factor 1
- POU domain, class 2, transcription factor 2
- Potassium voltage-gated channel subfamily H member 2
- Prolyl endopeptidase
- Solute carrier family 22 member 8
- Solute carrier organic anion transporter family member 1B1 (OATP1B1)
| - (R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-1H-purine-2,6(3H,7H)-dione
- 8-[(3R)-3-Aminopiperidin-1-yl]-7-but-2-yn-1-yl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
- CHEMBL237500
- LINAGLIPTIN
- US10202383, Example 2(142)
- US10358449, Linagliptin
- US9255098, Linagliptin
- US9321791, 2(142)
- US9556175, 2(142)
|
BDBM50230993
 | 7 | 38 | 0 | 0 | 0 | 0 | 0 | 0 | - Nitric Oxide Synthase, endothelial
- Nitric Oxide Synthase, inducible
- Nitric oxide synthase, brain
- Nitric oxide synthase, endothelial
- Nitric oxide synthase, inducible
- Nitric-oxide synthase, brain
| - (2S)-2-amino-5-[(N-methylcarbamimidoyl)amino]pentanoic acid
- (2S)-2-ammonio-5-{[iminio(methylamino)methyl]amino}pentanoate
- (R)-2-Amino-5-(N'-methyl-guanidino)-pentanoic acid
- (S)-2-Amino-5-(N'-methyl-guanidino)-pentanoic acid
- (S)-2-amino-5-(2-methylguanidino)pentanoic acid
- (S)-2-amino-5-(3-methylguanidino)pentanoic acid
- 2-Amino-5-(N'-methyl-guanidino)-pentanoic acid
- CHEMBL256147
- L-NMMA
- N omega-methyl-L-arginine
- N(G)-mono-methyl-L-arginine
- N(G)-monomethyl-L-arginine
- N-Monomethyl-L-arginine
- N-gamma-monomethyl-L-arginine
- NG-Monomethyl-L-Arginine
- NG-monomethyl-L-arginine acetate
- Ngamma-monomethyl-L-arginine
- Targinine
|
BDBM50238632
 | 4 | 41 | 0 | 0 | 0 | 0 | 0 | 0 | - Cereblon/Histone deacetylase 6
- Coagulation factor VII/tissue factor
- Histone deacetylase
- Histone deacetylase 1
- Histone deacetylase 2
- Histone deacetylase 3
- Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)
- Histone deacetylase 4
- Histone deacetylase 8
- Histone deacetylase-like amidohydrolase
| - (6S,9S,12S,14aR)-6-((S)-sec-Butyl)-9-(1-methoxy-1H-indol-3-ylmethyl)-12-(6-oxo-octyl)-decahydro-4a,7,10,13-tetraaza-benzocyclododecene-5,8,11,14-tetraone
- CHEMBL430060
- ChEMBL_275631
|
BDBM50241132
 | 29 | 8 | 6 | 2 | 0 | 0 | 0 | 0 | - Cholinergic, muscarinic
- Muscarinic acetylcholine receptor M1
- Muscarinic acetylcholine receptor M2
- Muscarinic acetylcholine receptor M2 and M5
- Muscarinic acetylcholine receptor M3
- Muscarinic acetylcholine receptor M4
- Muscarinic acetylcholine receptor M5
- Muscarinic receptor 4
| - 3-Hydroxy-2-phenyl-propionic acid 9-methyl-3-oxa-9-aza-tricyclo[3.3.1.0*2,4*]non-7-yl ester
- 7-(3-Hydroxy-2-phenyl-propionyloxy)-9,9-dimethyl-3-oxa-9-azonia-tricyclo[3.3.1.0*2,4*]nonane
- CHEMBL376897
- METHSCOPOLAMINE
- Methyl scopolamine
- N-METHYLSCOPOLAMINE
|
BDBM50354086
 | 3 | 40 | 0 | 2 | 0 | 0 | 0 | 0 | - Cereblon/Histone deacetylase 6
- Histone deacetylase 1
- Histone deacetylase 10
- Histone deacetylase 11
- Histone deacetylase 2
- Histone deacetylase 3
- Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)
- Histone deacetylase 4
- Histone deacetylase 5
- Histone deacetylase 6
- Histone deacetylase 7
- Histone deacetylase 8
- Histone deacetylase 9
- Nuclear receptor corepressor 1
| |
BDBM50367247
 | 11 | 32 | 1 | 1 | 0 | 0 | 0 | 0 | - Adrenaline alpha1
- Adrenaline alpha2
- Adrenergic Alpha
- Bile salt export pump
- Canalicular multispecific organic anion transporter 1
- Canalicular multispecific organic anion transporter 2
- Cystic fibrosis transmembrane conductance regulator
- Cytochrome P450 2D1
- Cytochrome P450 2D18
- Cytochrome P450 2D2
- Cytochrome P450 2D3
- Cytochrome P450 2D6
- Cytochrome P450 2D6 (2D6)
- Histidine-rich protein
- Multidrug resistance protein 1/Multidrug resistance associated protein 1
- Multidrug resistance-associated protein 4
- P-glycoprotein 1
- Serum albumin
- Sodium channel protein type I I alpha subunit
- Solute carrier family 22 member 1
- Solute carrier family 22 member 2
- Solute carrier organic anion transporter family member 1A1
- Solute carrier organic anion transporter family member 1A4
- Twik-RElated Potassium (K+) channel 1 (TREK1)
| - QUININE
- Quinamm
- Quinsan
- cid_3034034
|
BDBM50381716
 | 2 | 43 | 0 | 0 | 0 | 0 | 0 | 0 | - ALK tyrosine kinase receptor
- Aurora kinase A/Targeting protein for Xklp2
- Aurora kinase B
- Cyclin-dependent kinase 9
- Cytochrome P450 3A
- Fibroblast growth factor receptor 1
- Glycogen synthase kinase-3
- Insulin-like growth factor I receptor
- Macrophage colony stimulating factor receptor
- Mast/stem cell growth factor receptor Kit
- Platelet-derived growth factor receptor alpha
- Platelet-derived growth factor receptor beta
- Potassium voltage-gated channel subfamily H member 2
- Proto-oncogene tyrosine-protein kinase receptor Ret
- Rho-associated protein kinase 1
- Tyrosine-protein kinase ABL1
- Tyrosine-protein kinase Fyn
- Tyrosine-protein kinase JAK2
- Tyrosine-protein kinase JAK3
- Tyrosine-protein kinase Lck
- Tyrosine-protein kinase receptor FLT3
- Vascular endothelial growth factor receptor 1
- Vascular endothelial growth factor receptor 2
| - ABT-348
- ILORASERTIB
- US8722890, 1
- US8722890, 2
|
BDBM50413752
 | 0 | 45 | 0 | 0 | 0 | 0 | 0 | 0 | - ALK tyrosine kinase receptor
- Aurora kinase A/Targeting protein for Xklp2
- Axin-1/Glycogen synthase kinase-3 beta
- Cyclin-dependent kinase 2
- Dual specificity mitogen-activated protein kinase kinase 2
- Dual specificity mitogen-activated protein kinase kinase 6
- Dual specificity mitogen-activated protein kinase kinase; MEK1/2
- Ephrin receptor
- Ephrin type-B receptor 4
- Fibroblast growth factor receptor 3
- Focal adhesion kinase 1/vascular endothelial growth factor receptor 3
- Hepatocyte growth factor receptor
- Insulin receptor
- Insulin-like growth factor I receptor
- MAP kinase-activated protein kinase 5
- Mast/stem cell growth factor receptor Kit
- Mitogen-activated protein kinase 1
- Mitogen-activated protein kinase 14
- Non-receptor tyrosine-protein kinase TYK2
- Protein kinase N1
- Protein kinase N2
- Proto-oncogene tyrosine-protein kinase receptor Ret
- Receptor tyrosine-protein kinase erbB-2
- Rho-associated protein kinase 2
- Serine/threonine-protein kinase receptor R3
- Tyrosine-protein kinase BTK
- Tyrosine-protein kinase JAK1
- Tyrosine-protein kinase JAK2
- Tyrosine-protein kinase JAK3
- Tyrosine-protein kinase Lck
- Tyrosine-protein kinase ZAP-70
- Tyrosine-protein kinase receptor FLT3
- Tyrosine-protein kinase receptor UFO
- Vascular endothelial growth factor receptor 2
- Vascular endothelial growth factor receptor 3
- [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial
- cAMP-dependent protein kinase (PKA)
| |
BDBM84342
 | 42 | 2 | 1 | 0 | 0 | 0 | 0 | 0 | - 5-hydroxytryptamine receptor 7
- ADRA1A
- ADRA1B
- ADRA2A
- Alpha adrenergic receptor 1A and 1B
- Alpha-1A adrenergic receptor
- Alpha-2A adrenergic receptor
- Alpha-2B adrenergic receptor
- Alpha-2C adrenergic receptor
- Beta-1 adrenergic receptor
- Beta-2 adrenergic receptor
- Beta-3 adrenergic receptor
- Beta-adrenergic receptor kinase 1
- Cerebral cortex alpha adrenergic receptor
- D(2) dopamine receptor
- DRD1
- Norepinephrine transporter
- Serotonin (5-HT) receptor
- Sodium-dependent noradrenaline transporter
- Steroidogenic Factor 1
- adrenergic Alpha1
- adrenergic Alpha2
- nuclear receptor subfamily 0 group B member 1
| - 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
- 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol, 1
- 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol;hydrochloride
- 4-[1-hydroxy-2-(methylamino)ethyl]pyrocatechol;hydrochloride
- 4-[2-(methylamino)-1-oxidanyl-ethyl]benzene-1,2-diol;hydrochloride
- DL-ADRENALINE HYDROCHLORIDE
- EPINEPHRINE
- EPINEPHRINE,(+)
- MLS001333244
- SMR000058236
- cid_5924
|
BDBM86198
 | 45 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | - 5-hydroxytryptamine receptor 1A
- 5-hydroxytryptamine receptor 2A
- 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
- Calcium channel
- Cannabinoid receptor 1
- Cholinergic, Nicotinic Alpha3Beta2
- D(1A) dopamine receptor
- D(1B) dopamine receptor
- D(2) dopamine receptor
- Dopamine receptor
- Gamma-aminobutyric acid receptor subunit alpha-1
- Glutamate receptor ionotropic, NMDA 1
- Histamine H1 receptor
- Histamine H2 Receptor
- Histamine H4 receptor
- Imidazoline I1
- 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
- Neuronal acetylcholine receptor
- Neuronal acetylcholine receptor subunit alpha-4
- Neuronal acetylcholine receptor; alpha2/beta2
- OPRD1
- Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
- Sodium-dependent dopamine transporter
- Sodium-dependent noradrenaline transporter
- Sodium-dependent serotonin transporter
| - CAS_134505
- L-homocysteine thiolactone
- NSC_134505
|
BDBM86205
 | 45 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | - 5-hydroxytryptamine receptor 1A
- 5-hydroxytryptamine receptor 1B
- 5-hydroxytryptamine receptor 2A
- 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-2C adrenergic receptor
- Beta-1 adrenergic receptor
- Beta-2 adrenergic receptor
- Calcium channel
- Cannabinoid receptor 1
- Cholinergic, Nicotinic Alpha3Beta2
- D(1A) dopamine receptor
- D(1B) dopamine receptor
- D(2) dopamine receptor
- Dopamine receptor
- Gamma-aminobutyric acid receptor subunit alpha-1
- Glutamate receptor ionotropic, NMDA 1
- Histamine H1 receptor
- Histamine H2 Receptor
- Histamine H4 receptor
- Imidazoline I1
- 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
- Neuronal acetylcholine receptor
- Neuronal acetylcholine receptor subunit alpha-4
- Neuronal acetylcholine receptor; alpha2/beta2
- OPRD1
- Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
- Sodium-dependent dopamine transporter
- Sodium-dependent noradrenaline transporter
- Sodium-dependent serotonin transporter
| - D-homocysteine thiolactone
|
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