Compound Name (alphabetical) | Enz. Inhib. Data | ITC Data | Binding Targets | Alternate Compound Names |
---|
Ki | IC50 | Kd | EC50 | Koff | Kon | Other |
---|
BDBM13076
 | 59 | 6 | 0 | 1 | 0 | 0 | 0 | 0 | - Astrosclerin-3
- Bile salt export pump
- Canalicular multispecific organic anion transporter 1
- Canalicular multispecific organic anion transporter 2
- Carbonate dehydratase
- Carbonic Anhydrase III
- Carbonic Anhydrase VA
- Carbonic Anhydrase VB
- Carbonic Anhydrase XIII
- Carbonic Anhydrase XIV
- Carbonic anhydrase
- Carbonic anhydrase 1
- Carbonic anhydrase 12
- Carbonic anhydrase 2
- Carbonic anhydrase 4
- Carbonic anhydrase 6 (CA-VI)
- Carbonic anhydrase 7
- Carbonic anhydrase 9
- Carbonic anhydrase, alpha family
- Cytochrome P450 2J2
- Delta carbonic anhydrase
- Hsf1 protein
- Multidrug resistance-associated protein 4
- Serum albumin
- Solute carrier family 22 member 6
| - 6-chloro-1,1-dioxo-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide
- BMCL182567 Compound 6a
- Dichlothiazide
- Hydro-D
- Hydrochlorothiazide
- Hypothiazide
- JFD00715
- Oretic
- cid_3639
|
BDBM143761
 | 66 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | - Orexin receptor type 1
- Orexin receptor type 1 (OX1)
- Orexin receptor type 2
- Orexin receptor type 2 (OX2)
| - US10183953, Example 25
- US8969352, 22
- US8969352, 23
- US8969352, 24
- US8969352, 25
- US9611277, Example 25
- US9845333, 25
|
BDBM50002369
 | 39 | 2 | 1 | 24 | 0 | 0 | 0 | 0 | - GRIA1
- GRIA2
- GRIA3
- GRIK1
- GRIK4
- Glutamate kainate
- Glutamate receptor 1
- Glutamate receptor ionotropic AMPA
- Glutamate receptor ionotropic kainate
- Glutamate receptor ionotropic kainate 4
- Glutamate receptor ionotropic kainate 5
- Glutamate receptor ionotropic, AMPA 2
- Glutamate receptor ionotropic, AMPA 4
- Glutamate receptor ionotropic, NMDA 1
- Glutamate receptor ionotropic, kainate
- Glutamate receptor ionotropic, kainate 1
- Glutamate receptor ionotropic, kainate 2
- Glutamate-Kainate 7
- Grik5
- Ionotropic glutamate receptor kainate 2/5
- Metabotropic glutamate receptor 5
- Metabotropic glutamate receptor 6
| - (2S-(2alpha,3beta,4beta))-2-carboxy-4-(1-methylethenyl)-3-pyrrolidineacetic acid
- (3S,4R)-3-(carboxymethyl)-4-(prop-1-en-2-yl)-L-proline
- CHEMBL275040
- Digenin
- Digensaeure
- Helminal
- Kainate
- Kainsaeure
- L-alpha-kainic acid
- alpha-Kainic acid
- digenic acid
- kainic acid
|
BDBM50017712
 | 23 | 41 | 1 | 1 | 0 | 0 | 0 | 0 | - 15-Lipoxygenase (LoxA)
- 5-HT3A Serotonin Receptor
- 5-hydroxytryptamine receptor 1A
- 5-hydroxytryptamine receptor 2A
- ATP-binding cassette sub-family G member 2
- Adrenaline alpha1
- Bile salt export pump
- Bile salt export pump (BSEP)
- Canalicular multispecific organic anion transporter 1
- Canalicular multispecific organic anion transporter 2
- Cystic fibrosis transmembrane conductance regulator
- D(1A) dopamine receptor
- D(2) dopamine receptor
- D(3) dopamine receptor
- DNA topoisomerase I (Topo I)
- Multidrug resistance protein 1/Multidrug resistance associated protein 1
- Multidrug resistance-associated protein 2 (MRP2)
- Multidrug resistance-associated protein 4
- P-glycoprotein 1
- P-glycoprotein 1 and 3 (MDR1a/MDR1b)
- Quinolone resistance protein norA
- Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
- Sodium channel protein type I I alpha subunit
- Sodium-dependent dopamine transporter
- Synaptic vesicular amine transporter
- Vesicular monoamine transporter 2 (VMAT P314G)
- Vesicular monoamine transporter 2 (VMAT P314L)
- Vesicular monoamine transporter 2 (VMAT P314T)
- Vesicular monoamine transporter 2 (VMAT V41A)
- Vesicular monoamine transporter 2 (VMAT V41I)
- Vesicular monoamine transporter 2 (VMAT2 G308A)
- Vesicular monoamine transporter 2 (VMAT2 G308P)
- Vesicular monoamine transporter 2 (VMAT2 V132A)
- Vesicular monoamine transporter 2 (VMAT2 V132G)
- Vesicular monoamine transporter 2 (VMAT2)
| - (-)-reserpine
- (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester
- 3,4,5-trimethoxybenzoyl methyl reserpate
- Apoplon
- CHEMBL772
- NCGC00091250
- RESERPINE
- Reserpin
- Serpalan
- cid_5770
- methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate
|
BDBM50086441
 | 0 | 66 | 0 | 0 | 0 | 0 | 0 | 0 | - Aurora kinase A/Targeting protein for Xklp2
- Axin-1/Glycogen synthase kinase-3 beta
- B-RAF V600E
- Bcr-Abl
- Cyclin-dependent kinase 2
- Cyclin-dependent kinase 7
- Cytoplasmic tyrosine-protein kinase BMX
- Discoidin domain-containing receptor 2
- Dual specificity mitogen-activated protein kinase kinase 1
- Ephrin receptor
- Ephrin type-A receptor 2
- Ephrin type-B receptor 2
- Epidermal growth factor receptor
- Epithelial discoidin domain-containing receptor 1
- Fibroblast growth factor receptor 1
- Focal adhesion kinase 1
- High affinity nerve growth factor receptor
- Inhibitor of NF-kappa-B kinase alpha/beta
- Inhibitor of nuclear factor kappa-B kinase subunit alpha
- Inhibitor of nuclear factor kappa-B kinase subunit beta
- Mitogen-activated protein kinase 1
- Mitogen-activated protein kinase 10
- NUAK family SNF1-like kinase 1
- Nuclear receptor subfamily 2 group C member 2
- PAK 1/CDC42
- Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
- Platelet-derived growth factor receptor
- Platelet-derived growth factor receptor alpha
- Protein kinase C alpha type
- Proto-oncogene tyrosine-protein kinase Src
- Proto-oncogene tyrosine-protein kinase Src (T341M)
- Proto-oncogene tyrosine-protein kinase Src (aa 1-530)
- RAC-alpha serine/threonine-protein kinase
- RAF proto-oncogene serine/threonine-protein kinase
- Serine/threonine-protein kinase AKT2
- Serine/threonine-protein kinase B-raf
- Serine/threonine-protein kinase Chk1/2
- Serine/threonine-protein kinase TBK1
- Serine/threonine-protein kinase pim-1
- TAK1/TAB1
- Tyrosine-protein kinase ABL1
- Tyrosine-protein kinase BTK
- Tyrosine-protein kinase Blk
- Tyrosine-protein kinase Fyn
- Tyrosine-protein kinase JAK2
- Tyrosine-protein kinase Yes
- Tyrosine-protein kinase receptor UFO
- Vascular endothelial growth factor receptor 2
| - CHEMBL3426225
- US10266537, Compound 3
|
BDBM50163858
 | 0 | 0 | 42 | 0 | 12 | 12 | 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
| - CHEMBL2443188
- carbonic anhydrase (CA) inhibitors, benzenesulphonamide ligand, 7
|
BDBM50184359
 | 0 | 27 | 0 | 39 | 0 | 0 | 0 | 0 | - Melanocortin receptor 1
- Melanocortin receptor 3
- Melanocortin receptor 4
- Melanocortin receptor 5 (MC5R)
- Melanocyte-stimulating hormone receptor
| - (3S,6S,9R,12S,15S,23S)-15-((S)-2-acetylamino-hexanoylamino)-9-benzyl-6-(3-guanidino-propyl)-12-(3H-imidazol-4-ylmethyl)-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18hexaaza-cyclotricosane-23-carboxylic acid amide
- Ac-Nle-c[Asp-His-D-Phe-Arg-Trp-Lys]-NH2
- Ac-Nle-c[Asp-His-DPhe-Arg-Trp-Lys]-NH2
- CHEMBL430239
- MT-II
- ebi_340792
|
BDBM50322535
 | 1 | 60 | 3 | 2 | 0 | 0 | 0 | 0 | - 1,3-beta-glucan synthase component GLS2
- ABL Mutant (T315I)
- Axin-1/Glycogen synthase kinase-3 beta
- Bcr-Abl
- Coiled-coil domain-containing protein 6/Tyrosine-protein kinase receptor RET
- Cytochrome P450
- Ephrin type-A receptor 2 (EPHA2)
- Epidermal growth factor receptor
- Fibroblast growth factor receptor 1
- Fibroblast growth factor receptor 2
- Fibroblast growth factor receptor 3
- Fibroblast growth factor receptor 4
- Glycogen Synthase Kinase 3 (GSK3)
- Leucine-rich repeat kinase 2 (LRRK2 t-WT)
- Mast/stem cell growth factor receptor Kit
- Mitogen-activated protein kinase 10/Receptor-interacting serine/threonine-protein kinase 1
- Platelet-derived growth factor receptor alpha
- Platelet-derived growth factor receptor beta
- Protein cereblon/Tyrosine-protein kinase SRC
- Proto-oncogene tyrosine-protein kinase Src
- Proto-oncogene tyrosine-protein kinase Src (c-Src)
- Proto-oncogene tyrosine-protein kinase receptor Ret
- Receptor-interacting serine/threonine-protein kinase 3
- Serine/threonine-protein kinase RIPK2
- TEL/KDR
- Tyrosine-protein kinase ABL1
- Tyrosine-protein kinase ABL1 (c-Abl)
- Tyrosine-protein kinase Lyn
- Vascular endothelial growth factor receptor 1
- Vascular endothelial growth factor receptor 2
| - 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}benzamide
- 3-[2-(Imidazo[1,2-b]pyridazin-3-yl)ethynyl]-4-methyl-N-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}benzamide
- CHEMBL1171837
- PONATINIB
- US10464902, Ponatinib
- US9255107, AP24534
|
BDBM9460
 | 11 | 54 | 0 | 1 | 0 | 0 | 0 | 0 | - Bile salt export pump
- Canalicular multispecific organic anion transporter 1
- Canalicular multispecific organic anion transporter 2
- Cytochrome P450 11A1
- Cytochrome P450 11A1 (CYP11A1)
- Cytochrome P450 11B2
- Cytochrome P450 17A1
- Cytochrome P450 19A1
- Multidrug resistance-associated protein 4
| - 3-(4-aminophenyl)-3-ethyl-piperidine-2,6-dione
- 3-(4-aminophenyl)-3-ethylpiperidine-2,6-dione
- Aminoglutethimide AG, 4
- CHEMBL488
- Cytadren
- Elipten
- aminoglutethimide (AG)
|