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Compounds Sorted by Binding Targets per Compound

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Compounds Sorted Alphabetically

Compound Name (alphabetical)	Binding Targets	Enz. Inhib. Data							ITC Data	Alternate Compound Names
		Ki	IC50	Kd	EC50	Koff	Kon	Other
BDBM14775	3',5'-cyclic phosphodiesterase Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B Phosphodiesterase 4 Phosphodiesterase 4A Phosphodiesterase 8 Phosphodiesterase Type 10 (PDE10A) Phosphodiesterase Type 11 (PDE11A) Phosphodiesterase Type 2 (PDE2A) Phosphodiesterase Type 3 (PDE3B) Phosphodiesterase Type 4 (PDE4B) Phosphodiesterase Type 4 (PDE4D) Phosphodiesterase Type 5 (PDE5A) Phosphodiesterase Type 7 (PDE7B) Phosphodiesterase Type 9 (PDE9A) cAMP-specific 3',5'-cyclic phosphodiesterase 4A cAMP-specific 3',5'-cyclic phosphodiesterase 4B cAMP-specific 3',5'-cyclic phosphodiesterase 4C isoform 1 cAMP-specific 3',5'-cyclic phosphodiesterase 4D	11	37	0	0	0	0	0	0	3-(cyclopentyloxy)-N-(3,5-dichloropyridin-4-yl)-4-methoxybenzamide 3-cyclopentyloxy-N-(3,5-dichloropyridin-4-yl)-4-methoxy-benzamide CHEMBL42126 Cpodpmb Piclamilast RPR-73401
BDBM15579	5-HT3A Serotonin Receptor 5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 2A Acetylcholinesterase Amine oxidase (flavin-containing) A Amine oxidase [flavin-containing] B Bile salt export pump Canalicular multispecific organic anion transporter 1 Canalicular multispecific organic anion transporter 2 Cholinesterases Cytochrome P450 2B1 D(1A) dopamine receptor D(2) dopamine receptor Monoamine Oxidase Type A (MAO-A) Monoamine Oxidase Type B (MAO-B) Monoamine oxidase Multidrug resistance-associated protein 4 Serotonin receptor 2a and 2c (5HT2A and 5HT2C)	43	188	1	0	0	0	0	0	CHEMBL972 DEPRENYL L-Deprenyl N-methyl-N-[(2R)-1-phenylpropan-2-yl]prop-2-yn-1-amine SLG Selegiline US8633208, Deprenyl US9469653, Selegiline methyl[(2R)-1-phenylpropan-2-yl]prop-2-yn-1-ylamine
BDBM18627	Androgen Receptor Androgen receptor/Baculoviral IAP repeat-containing protein 2 Bile salt export pump Canalicular multispecific organic anion transporter 1 Canalicular multispecific organic anion transporter 2 Cytochrome P450 Cytochrome P450 2C8 Cytochrome P450 2C9 Cytochrome P450 3A Estrogen receptor Glucocorticoid Glucocorticoid receptor Mineralocorticoid receptor Multidrug resistance-associated protein 4 P-glycoprotein (P-gp) Progesterone receptor Thyroid hormone receptor alpha Thyroid hormone receptor beta	44	133	2	13	0	0	0	0	(10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]-14-hydroxy-15-methyl-14-(prop-1-yn-1-yl)tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1,6-dien-5-one Mifeprex Mifepristone RU-486 RU486 (tetramethyl-rhodamine conjugated)
BDBM205429	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)) BRD4 bromodomain 1 BRD4 bromodomain 2 Bromodomain testis (1, 2) (BRDT(1,2)) Bromodomain testis 1 (BRDT(1)) Bromodomain testis 2 (BRDT(2)) Bromodomain-containing protein 4 Bromodomain-containing protein 4 (BRD4) Bromodomain-containing protein 4 (BRD4) (aa 44-168) Bromodomain-containing protein 4 Bromo 1 domain(BRD4 BD1) Bromodomain-containing protein 4 Bromo 2 domain(BRD4 BD2)	0	8	14	0	0	0	0	0	(R)-JQ1 (3) US10407441, Compound (R)-JQ1 US10925881, Name (R)-JQ1 US9320741, (R)-JQ1
BDBM21220	5-hydroxytryptamine receptor 2A ADORA1 ADORA3 Adenosine A1 receptor Adenosine A2 receptor Adenosine Receptors A2a (A2a) Adenosine receptor Adenosine receptor A1 Adenosine receptor A1 (A1) Adenosine receptor A2a Adenosine receptor A2a and A3 Adenosine receptor A2b Adenosine receptor A3 Adenosine receptors; A2a & A2b Endoplasmin G protein-coupled receptor 80 Sodium/nucleoside cotransporter 2 Transmembrane domain-containing protein TMIGD3	234	23	4	62	0	0	0	0	(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide Adenosine analog, 3 Adenosine, N6-Ethyl-carboxamido Adenosine-5-(N-ethylcarboxamide) CHEMBL464859 N-Ethylcarboxamidoadenosine NECA
BDBM22418	5-HT3A Serotonin Receptor 5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 2A D(1A) dopamine receptor D(2) dopamine receptor Dopamine transporter Monoamine transporter Monoamine transporters; Norepininephrine & dopamine Muscarinic acetylcholine receptor M1 Norepinephrine Monoamine transporters Norepinephrine transporter Potassium voltage-gated channel subfamily H member 2 Serotonin receptor 2a and 2c (5HT2A and 5HT2C) Sigma non-opioid intracellular receptor 1 Sodium channel protein type I I alpha subunit Sodium-dependent dopamine transporter Sodium-dependent noradrenaline transporter Sodium-dependent serotonin transporter	93	60	0	6	0	0	0	0	Cocaine Cocaine (-) methyl (1R,2R,3S,5S)-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate methyl (1R,2R,3S,5S)-8-methyl-3-[(phenylcarbonyl)oxy]-8-azabicyclo[3.2.1]octane-2-carboxylate
BDBM22889	Adrenergic Alpha Aldehyde oxidase Cytochrome P450 3A HRH3 Histamine H1 receptor Histamine H2 receptor Histamine H3 receptor Histamine H4 receptor Multidrug and toxin extrusion protein 1 Multidrug and toxin extrusion protein 2 P-glycoprotein (P-gp) P-glycoprotein 1 P-glycoprotein 1 and 3 (MDR1a/MDR1b) Potassium-transporting ATPase alpha chain 1/beta chain Solute carrier family 22 member 11 Solute carrier family 22 member 2 Solute carrier family 22 member 6 Solute carrier family 22 member 8	10	18	0	0	0	0	0	0	(Cimetidine) N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-guanidine,cyanide (Cimetidine)N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]cyanomethyliminomethanediamine (cimetidine) N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]cyanoiminomethanediamine 1-cyano-2-methyl-3-(2-((5-methyl-1H-imidazol-4-yl)methylthio)ethyl)guanidine 1-cyano-2-methyl-3-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine 2-Chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)-benzenesulfonamide(Cimetidine) 2-Methyl-8-phenethyl-imidazo[1,2-a]pyridine-3-carboxylic acid methyl ester(cimetidine) 2-methylamino-2-[2-(4-methyl-1H-5-imidazolylmethylsulfanyl)ethylamino]-(E)-1-imino cyanide 2-methylamino-2-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethylamino]-(Z)-1-imino cyanide(cimetidine) ; N''''''''-cyano-N-methyl-N''''-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)-ethyl)guanidine CHEMBL30 CIMETIDINE Cimetidine Eureceptor N''''''''''''''''-cyano-N-methyl-N''''''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]-lambda~4~-sulfanyl}ethyl)guanidine N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine (Cimetidine) N''''''''-cyano-N-methyl-N''''-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine(cimetidine) N''''''''-cyano-N-methyl-N''''-({[(5-methyl-1H-imidazol-4-yl)methyl]thio}methyl)guanidine(cimetidine) N-Cyano-N''''-methyl-N''''''''-(2-(((5-methyl-1H-imidazol-4-yl) methyl)thio)ethyl)guanidine(Cimetidine) N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-N''''''''-Cyano-guanidine N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-N''''''''-cyano-guanidine(Cimetidine) N-Methyl-N''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-cyanoguanidine(cimetidine) N-cyanomethyl-N''''-methyl-N''''''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-guanidine ( Cimetidine) N-methyl-N''''-cyano-N''''''''-[2-(5-methyl-1H-imidazol-4-ylmethylsulfanyl)-ethyl]-guanidine N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]-1-cyanoiminomethanediamine N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]cyanoiminomethanediamine (cimetidine) N-methyl-N-[2-(5-methyl-1H-4-imidazolylmethylsulfanyl)ethyl]imino(-N-cyano)methanediaminem N-tert-Butyl-N''''-[4-(1H-imidazol-4-yl)-phenyl]-formamidine(cimetidine) Tagamet Tagamet HB Tagamet hb 200 cemitidine
BDBM23971	72 kDa type IV collagenase Aminopeptidase Aminopeptidase B Aminopeptidase N Bacterial leucyl aminopeptidase Cystinyl aminopeptidase Cytosol aminopeptidase Dipeptidyl peptidase 4 Gelatinase 2 (MMP-2) Histone deacetylase (HDAC1 and HDAC2) Leucine aminopeptidase Leucyl-cystinyl aminopeptidase Leukotriene A4 hydrolase Oligopeptide transporter small intestine isoform Oligopeptide transporter, kidney isoform Phospholipase A2, membrane associated Solute carrier family 15 member 1 Zinc aminopeptidase	20	110	3	0	0	0	0	0	(2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanamido]-4-methylpentanoic acid Bestatin CHEMBL29292 Ubenimex
BDBM255474	5-hydroxytryptamine receptor 1B 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2B 5-hydroxytryptamine receptor 2C 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 D(1A) dopamine receptor D(2) dopamine receptor D(3) dopamine receptor Gamma-aminobutyric acid receptor subunit alpha-1 Histamine H1 receptor	22	1	0	1	0	0	0	0	US9481688, 1 US9481688, 3
BDBM25764	5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 2A ADRB2 Adrenergic receptor beta Alpha-1A adrenergic receptor Beta-1 adrenergic receptor Beta-2 adrenergic receptor Beta-3 adrenergic receptor Bile salt export pump Canalicular multispecific organic anion transporter 1 Canalicular multispecific organic anion transporter 2 Cytochrome P450 2J2 D(2) dopamine receptor HTR2C Multidrug resistance-associated protein 4 Serotonin (5-HT) receptor Serotonin 1B/1D receptor Squalene synthetase	22	13	14	0	0	0	0	0	ALPRENOLOL,(+) ALPRENOLOL,(-) Alfeprol Alpheprol Alprenolol CHEMBL266195 {2-hydroxy-3-[2-(prop-2-en-1-yl)phenoxy]propyl}(propan-2-yl)amine
BDBM2672	CDK2/CycE CDK2/Cyclin E/G1/S-specific cyclin E2 CDK7/Cyclin H/MNAT1 CaM Kinase II CaM kinase II Cyclic AMP-dependent protein kinase (PKA) Cyclin B/Cyclin-Dependent Kinase 1 (CDK1)/G2/mitotic-specific cyclin B2/G2/mitotic-specific cyclin B3 Cyclin-Dependent Kinase 1 (CDK1) Cyclin-Dependent Kinase 2 (CDK2) Cyclin-Dependent Kinase 4 (CDK4) Cyclin-Dependent Kinase 5 (CDK5) Cyclin-Dependent Kinase 9 (CDK9) Epidermal growth factor receptor Protein kinase C (PKC) Protein kinase C alpha type cAMP-Dependent Protein Kinase (PKA) cAMP-dependent protein kinase (PKA) cAMP-dependent protein kinase catalytic subunit gamma	0	31	0	0	0	0	0	0	3,13,23-triazahexacyclo[14.7.0.0^{2,10}.0^{4,9}.0^{11,15}.0^{17,22}]tricosa-1(16),2(10),4(9),5,7,11(15),17(22),18,20-nonaene-12,14-dione 6,7,12,13-Tetrahydro-5,7-dioxo-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole CHEMBL268368 arcyriaflavin A
BDBM26806	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) ADAM17 ADAMTS1 Collagenase 3 Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10) Disintegrin and metalloproteinase domain-containing protein 17 Interstitial collagenase Matrix metalloproteinase 10 Matrix metalloproteinase 15 Matrix metalloproteinase 16 Matrix metalloproteinase-12 (MMP12) Matrix metalloproteinase-14 (MMP14) Matrix metalloproteinase-7 (MMP7) Matrix metalloproteinase-9 Neutrophil collagenase Stromelysin-1	14	6	0	0	0	0	0	0	(3R,4R)-3-N-hydroxy-4-N-(4-{[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]methyl}benzene)oxane-3,4-diamido CHEMBL253275 benzimidazole analog., 32
BDBM26980	α-Carbonic anhydrase (αCA) β-Carbonic anhydrase (βCA) Alpha carbonic anhydrase Alpha-carbonic anhydrase Astrosclerin-3 Beta-carbonic anhydrase 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 Carbonic anhydrase, alpha family Gamma-carbonic anhydrase	52	0	0	0	0	0	0	0	BROMIDE Br- CHEMBL11685 CHEMBL1644030 CHEMBL1644694 bromide bromide ion
BDBM26981	α-Carbonic anhydrase (αCA) β-Carbonic anhydrase (βCA) Alpha carbonic anhydrase Alpha-carbonic anhydrase Astrosclerin-3 Beta-carbonic anhydrase 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 Carbonic anhydrase, alpha family Gamma-carbonic anhydrase	52	0	0	0	0	0	0	0	CHEMBL1644695 CHEMBL185537 I- IODIDE POTASSIUM IODIDE iodide iodide ion
BDBM26997	α-Carbonic anhydrase (αCA) β-Carbonic anhydrase (βCA) Alpha carbonic anhydrase Alpha-carbonic anhydrase Astrosclerin-3 Beta-carbonic anhydrase Carbonic Anhydrase XIV Carbonic Anhydrase XV 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 Gamma-carbonic anhydrase beta-Carbonic Anhydrase	56	0	0	0	0	0	0	0	CHEMBL364571 PhAsO3H2 benzenarsonic acid benzenearsonic acid phenylarsonic acid
BDBM28583	5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2B 5-hydroxytryptamine receptor 2C 5-hydroxytryptamine receptor 6 5-hydroxytryptamine receptor 7 Adrenergic receptor alpha Cytochrome P450 1A Cytochrome P450 2C19 Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 3A D(1A) dopamine receptor D(2) dopamine receptor D(3) dopamine receptor D(4) dopamine receptor HTR6 Serotonin (5-HT) receptor	41	6	0	0	0	0	0	0	5-chloro-N-[4-methoxy-3-(piperazin-1-yl)phenyl]-3-methyl-1-benzothiophene-2-sulfonamide hydrochloride CHEMBL431298 SB 271046 SB-271046
BDBM29644	5-hydroxytryptamine receptor 1A Apoptosis regulator Bcl-2 BCL-W Bcl-2-related protein A1 Bile salt export pump D(2) dopamine receptor D(3) dopamine receptor DNA dC->dU-editing enzyme APOBEC-3G Dopamine receptor Induced myeloid leukemia cell differentiation protein Mcl-1 Isoform Bcl-X(L) MPI protein Opioid receptor POsterior Segregation family member (pos-1) RecName: Full=Zinc finger protein mex-5 Runt-Related Transcription Factor 1 Isoform AML1C Serotonin (5-HT) receptor eukaryotic translation initiation factor 4 gamma, 1 isoform 4	6	15	0	6	0	0	0	0	(6aR)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol;hydrate;hydrochloride APOMORPHINE HYDROCHLORIDE APOMORPHINE HYDROCHLORIDE HEMIHYDRATE MLS000069811 SMR000059235 cid_6852399
BDBM3033	Myosin light chain kinase, smooth muscle NAD-dependent deacetylase sirtuin 2 PKC alpha and beta-2 Polo-Like Kinase 3 Polo-Like Kinase 4 Protein Kinase C Protein kinase C (PKC) Protein kinase C alpha type Protein kinase C delta type Protein kinase C, gamma Serine/threonine-protein kinase D1 Serine/threonine-protein kinase PLK1 Serine/threonine-protein kinase PLK2 Serine/threonine-protein kinase PLK4 Tyrosine-Specific Protein Kinase Tyrosine-protein kinase BLK cAMP-Dependent Protein Kinase (PKA) cGMP-Dependent Protein Kinase	5	21	0	0	0	0	0	0	3-{23-methyl-14-oxo-3,13,23-triazahexacyclo[14.7.0.0^{2,10}.0^{4,9}.0^{11,15}.0^{17,22}]tricosa-1(16),2(10),4(9),5,7,11(15),17,19,21-nonaen-3-yl}propanenitrile CHEMBL302449 Go 6976 Indolocarbazole deriv.
BDBM32188	3',5'-cyclic phosphodiesterase Bile salt export pump Botulinum neurotoxin type A Canalicular multispecific organic anion transporter 1 Canalicular multispecific organic anion transporter 2 Carbonic anhydrase 15 Heat shock protein HSP 90-alpha Histone deacetylase 1 Histone deacetylase 2 Histone deacetylase 4 Histone deacetylase 5 Histone deacetylase 7 Histone deacetylase 8 Histone deacetylase 9 Kappa-type opioid receptor LAP4 MEP2 Multidrug resistance-associated protein 4	1	23	0	2	0	0	0	0	CLIOQUINOL Clioquinol (CQ) TG2-36-2 cid_2788
BDBM34737	Caspase-3 DNA dC->dU-editing enzyme APOBEC-3G Glucose 6-phosphate dehydrogenase (G6PD) Lysine-specific demethylase 5B M18 aspartyl aminopeptidase MPI protein Mannose-6-phosphate isomerase Probable global transcription activator SNF2L2 Procathepsin L eukaryotic translation initiation factor 4 gamma, 1 isoform 4 glucose-6-phosphate dehydrogenase glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase hexokinase neutrophil cytosolic factor 1 phosphatase, orphan 1 phosphomannomutase 2 probable DNA dC->dU-editing enzyme APOBEC-3A streptokinase A precursor	0	27	0	2	0	0	0	0	2-(4-methylphenyl)-1,2-benzisothiazol-3(2H)-one 2-(4-methylphenyl)-1,2-benzothiazol-3-one 2-(p-tolyl)-1,2-benzothiazol-3-one MLS000583746 SMR000200989 cid_935415
BDBM34966	DNA dC->dU-editing enzyme APOBEC-3G G protein signalling regulator 19 Glucose 6-phosphate dehydrogenase (G6PD) MPI protein MSRA protein Mannose-6-phosphate isomerase RGS7 Regulator of G-protein signaling 8 eukaryotic translation initiation factor 4 gamma, 1 isoform 4 glucose-6-phosphate dehydrogenase glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase hexokinase large T antigen neutrophil cytosolic factor 1 phosphatase, orphan 1 phosphomannomutase 2 regulator of G-protein signaling 4 regulator of G-protein signalling 16	0	21	0	7	0	0	0	0	3-(3-keto-1,2-benzothiazol-2-yl)-N,N-dimethyl-benzenesulfonamide MLS000773738 N,N-dimethyl-3-(3-oxidanylidene-1,2-benzothiazol-2-yl)benzenesulfonamide N,N-dimethyl-3-(3-oxo-1,2-benzothiazol-2-yl)benzenesulfonamide SMR000364449 cid_5040456
BDBM357013	Aurora kinase B Axin-1/Glycogen synthase kinase-3 beta CDK2/CycE Cytoplasmic tyrosine-protein kinase BMX Inhibitor of nuclear factor kappa-B kinase subunit epsilon Interleukin-1 receptor-associated kinase 1 Interleukin-1 receptor-associated kinase 4 Non-receptor tyrosine-protein kinase TYK2 Nuclear receptor subfamily 2 group C member 2 Serine/threonine-protein kinase TBK1 Tyrosine-protein kinase BTK Tyrosine-protein kinase ITK/TSK Tyrosine-protein kinase JAK2 Tyrosine-protein kinase JAK3 Tyrosine-protein kinase Lck Tyrosine-protein kinase Lyn Tyrosine-protein kinase TEC Tyrosine-protein kinase TXK	0	19	0	0	0	0	0	0	5-Phenyl-N-(pyridin-2-ylmethyl)-2-(pyrimidin-5-yl)quinazolin-4-amine US10214511, Example 1
BDBM39344	Acetylcholinesterase Acid phosphatase (acpA) Adrenaline alpha1 Adrenaline alpha2 Bile salt export pump Canalicular multispecific organic anion transporter 1 Canalicular multispecific organic anion transporter 2 D(2) dopamine receptor DNA (cytosine-5)-methyltransferase 1 (DNMT1) Genome polyprotein Multidrug resistance-associated protein 4 Muscarinic acetylcholine receptor M2 Potassium voltage-gated channel subfamily H member 2 Solute carrier family 22 member 1 Solute carrier family 22 member 2 Solute carrier family 22 member 3 Solute carrier family 22 member 4 Voltage-gated L-type calcium channel	12	23	0	0	0	0	0	0	4-amino-N-[2-(diethylamino)ethyl]benzamide;hydrochloride 4-azanyl-N-[2-(diethylamino)ethyl]benzamide;hydrochloride MLS000069436 PROCAINAMIDE PROCAINAMIDE HYDROCHLORIDE SMR000059079 cid_66068
BDBM40314	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	0	16	0	6	0	0	0	0	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
BDBM50000492	5-HT5B 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 7 HTR3A HTR4 HTR5A Neuronal acetylcholine receptor Serotonin (5-HT) receptor Serotonin 3 receptor (5HT3) Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor Serotonin receptor 2a and 2c (5HT2A and 5HT2C)	69	3	2	1	0	0	0	0	(zacopride)4-Amino-N-(1-aza-bicyclo[2.2.2]oct-3-yl)-5-chloro-2-methoxy-benzamide 4-Amino-N-(1-aza-bicyclo[2.2.2]oct-3-yl)-5-chloro-2-methoxy-benzamide 4-Amino-N-(1-aza-bicyclo[2.2.2]oct-3-yl)-5-chloro-2-methoxy-benzamide (Zacopride) 4-Amino-N-(1-aza-bicyclo[2.2.2]oct-3-yl)-5-chloro-2-methoxy-benzamide(zacopride) CHEMBL18041 HTR5A4-Amino-N-(1-aza-bicyclo[2.2.2]oct-3-yl)-5-chloro-2-methoxy-benzamide ZACOPRIDE ZACOPRIDE,R ZACOPRIDE,RS ZACOPRIDE,S
BDBM50005127	5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 1A (5HT1A) Adrenergic alpha1B Adrenergic receptor alpha-1 Adrenergic receptor alpha-2 Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor Alpha-1A adrenergic receptor Alpha-1D adrenergic receptor Bile salt export pump Cerebral cortex alpha adrenergic receptor D(2) dopamine receptor D(3) dopamine receptor D(4) dopamine receptor DRD1 Serotonin 1B/1D receptor Serotonin 2 (5-HT2) receptor Serotonin 2a (5-HT2a) receptor adrenergic Alpha2	26	20	0	1	0	0	0	0	1,1-Dioxo-2-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one 1,1-Dioxo-2-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one (Ipsapirone) 1,1-Dioxo-2-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-butyl]-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one(Ipsapirone) CHEMBL8412 IPSAPIRONE
BDBM50010231	α-Carbonic anhydrase (αCA) β-Carbonic anhydrase (βCA) Alpha-carbonic anhydrase Astrosclerin-3 Beta-carbonic anhydrase Carbonic Anhydrase XIII Carbonic anhydrase Carbonic anhydrase 1 Carbonic anhydrase 12 Carbonic anhydrase 2 Carbonic anhydrase 2, isoform A Carbonic anhydrase 4 Carbonic anhydrase 7 Carbonic anhydrase 9 Cytochrome P450 2E1 Gamma-carbonic anhydrase Histone-lysine N-methyltransferase EHMT1 Protein G9a (G9a)	41	3	0	0	0	0	0	0	CHEMBL107217 Ditiocarb sodium Sodium salt of Diethyl-dithiocarbamic acid(DDC) US9180183, DDTC sodium N,N-diethyl-dithiocarbamate sodium diethyldithiocarbamate
BDBM50015184	Arachidonate 5-lipoxygenase Carbonic anhydrase Carbonic anhydrase 2 Carbonic anhydrases; II & IX Cereblon/Histone deacetylase 6 Histone deacetylase 1 Histone deacetylase 2 Histone deacetylase 3 Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) Histone deacetylase 4 Histone deacetylase 5 Histone deacetylase 7 Histone deacetylase 8 Histone deacetylase 9 Indoleamine 2,3-dioxygenase Mandelate racemase (MR) PA/PB1 Stromelysin-1	5	20	1	0	0	0	0	0	BENZHYDROXAMIC ACID BENZOHYDROXAMATE CHEMBL16300 N-Hydroxy-benzamide N-hydroxybenzamide benzoyl hydroxamic acid
BDBM50030474	1,3-beta-glucan synthase component GLS2 Angiotensin II receptor (AT-1) type-1 Bile acid transporter Bile salt export pump Bile salt export pump (BSEP) CDGSH iron-sulfur domain-containing protein 1 CDGSH iron-sulfur domain-containing protein 2 Canalicular multispecific organic anion transporter 2 Free fatty acid receptor 1 Multidrug resistance-associated protein 4 Nuclear receptor coactivator 2 (aa 740-753) Nuclear receptor subfamily 4 group A member 2/Retinoic acid receptor RXR-alpha PPAR alpha/gamma 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	6	27	3	45	0	0	0	0	Avandamet Avandaryl Avandia BRL-49653 CHEBI:50122 ROSIGLITAZONE Rosiglitazone US10744117, Compound Rosiglitazone US9562012, rosiglitazone
BDBM50033111	ADRA1B Adrenergic Alpha Adrenergic alpha1B Adrenergic receptor Adrenergic receptor alpha-2 Alpha adrenergic receptor 1A and 1B Alpha-1A adrenergic receptor Alpha-1D adrenergic receptor Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor Bile salt export pump Canalicular multispecific organic anion transporter 1 Canalicular multispecific organic anion transporter 2 Cerebral cortex alpha adrenergic receptor Multidrug resistance-associated protein 4 Potassium voltage-gated channel subfamily H member 2 adrenergic Alpha1	64	6	4	4	0	0	0	0	1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-((tetrahydro-2-furanyl)carbonyl)piperazine 6,7-dimethoxy-2-[4-(tetrahydrofuran-2-ylcarbonyl)piperazin-1-yl]quinazolin-4-amine CHEMBL611 TERAZOSIN Terazosine
BDBM50038423	Aurora kinase A/Targeting protein for Xklp2 Aurora kinase B Axin-1/Glycogen synthase kinase-3 beta Casein kinase I isoform alpha Epidermal growth factor receptor Insulin-like growth factor I receptor Mitogen-activated protein kinase 1 Platelet-derived growth factor receptor alpha Protein kinase C alpha type RAC-alpha serine/threonine-protein kinase Serine/threonine-protein kinase Aurora-C Serine/threonine-protein kinase Nek1 Serine/threonine-protein kinase PLK1 Vascular endothelial growth factor receptor 1 Vascular endothelial growth factor receptor 2 Vascular endothelial growth factor receptor 3 cAMP-dependent protein kinase (PKA) p21-Activated kinase 2 (PAK2)	0	18	2	0	0	0	0	0	CHEMBL3361128
BDBM50048866	1,3-beta-glucan synthase component GLS2 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase 5-hydroxytryptamine receptor 1A Adrenergic receptor Alpha-2A adrenergic receptor D(2) dopamine receptor Muscarinic acetylcholine receptor M1 Muscarinic acetylcholine receptor M1 and M3 Muscarinic acetylcholine receptor M2 and M4 Muscarinic acetylcholine receptor M2 and M5 Muscarinic acetylcholine receptor M5 NMDA receptor subunit 2C (GluN2C) P-glycoprotein 1 Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor Sigma intracellular receptor 2 Sigma non-opioid intracellular receptor 1 Sigma-1 receptor Sigma-2 receptor	36	0	0	1	0	0	0	0	1-Cyclohexyl-4-[3-(5-methoxy-1,2,3,4-tetrahydro-naphthalen-1-yl)-propyl]-piperazine 1-cyclohexyl-4-(3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl)piperazine 1-cyclohexyl-4-[3-(5-methoxy-1,2,3,4-tetrahydro-naphthalen-1-yl)propyl]piperazine 1-cyclohexyl-4-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine CHEMBL53325 PB-28
BDBM50056101	5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 2A Alpha-1A adrenergic receptor Beta-2 adrenergic receptor CCKBR Cholecystokinin receptor D(1A) dopamine receptor D(2) dopamine receptor GRIA3 Gamma-aminobutyric acid receptor subunit alpha-1 Histamine H1 receptor Kappa-type opioid receptor Mu-type opioid receptor Muscarinic acetylcholine receptor M1 Muscarinic acetylcholine receptor M2 Muscarinic acetylcholine receptor M3 Sigma non-opioid intracellular receptor 1 adrenergic Alpha2	22	6	0	0	0	0	0	0	1-[(R)-2-Oxo-1-(2-oxo-2-o-tolyl-ethyl)-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl]-3-m-tolyl-urea CHEMBL115121 YM022 YM022 Racemate
BDBM50059654	Cytochrome P450 1A Cytochrome P450 2A6 Cytochrome P450 2B6 Cytochrome P450 2C19 Cytochrome P450 2C8 Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 2E1 Cytochrome P450 3A MAP kinase p38 Mast/stem cell growth factor receptor Kit Mitogen-activated protein kinase 10 Mitogen-activated protein kinase 8 Mitogen-activated protein kinase 9 Non-receptor tyrosine-protein kinase TYK2 Platelet-derived growth factor subunit B (PDGFB) Potassium voltage-gated channel subfamily H member 2 c-Jun N-terminal kinase 3	0	15	4	0	0	0	0	0	CHEMBL2144409
BDBM50061567	Cholinergic, Nicotinic Alpha3Beta2 DNA dC->dU-editing enzyme APOBEC-3G Neuronal acetylcholine receptor Neuronal acetylcholine receptor Alpha-3/Beta-2 Neuronal acetylcholine receptor Alpha-3/Beta-4 Neuronal acetylcholine receptor Alpha-4/Beta-2 Neuronal acetylcholine receptor protein alpha-2/beta-2 subunit Neuronal acetylcholine receptor protein alpha-3/beta-2 subunit Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit Neuronal acetylcholine receptor protein alpha-4/beta-4 subunit Neuronal acetylcholine receptor protein alpha-7 subunit Neuronal acetylcholine receptor subunit alpha-2 Neuronal acetylcholine receptor subunit alpha-3 Neuronal acetylcholine receptor subunit alpha-4 Neuronal acetylcholine receptor; alpha2/beta2 Nicotinic Alpha-Bungarotoxin n-AChR probable DNA dC->dU-editing enzyme APOBEC-3A	23	2	0	4	0	0	0	0	1,1-Dimethyl-4-phenyl-piperazin-1-ium CHEMBL134752 CHEMBL47814 DMPP cid_5911
BDBM50094968	5-hydroxytryptamine receptor 1A (5HT1A) 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C 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 Muscarinic acetylcholine receptor M4 Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit Serotonin 1B/1D receptor	18	0	0	0	0	0	0	0	3-(1-Methyl-4,5-dihydro-1H-imidazol-2-ylmethyl)-pyridine CHEMBL313631
BDBM50103601	Cell division protein FtsI (Peptidoglycan synthetase) Cytochrome P450 1A Cytochrome P450 2C19 Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 2J2 Cytochrome P450 3A D-amino-acid oxidase Penicillin binding protein 2' Penicillin-binding protein Penicillin-binding protein 1A Penicillin-binding protein 2B Penicillin-binding protein 2x Penicillin-binding protein 3 Peptidoglycan D,D-transpeptidase MrdA Solute carrier family 22 member 6 Solute carrier family 22 member 8 Voltage-gated L-type calcium channel	0	38	0	0	0	0	0	0	CEFTRIAXONE CHEBI:29007 Ceftriaxone
BDBM50105109	5-hydroxytryptamine receptor 1A 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 5A 5-hydroxytryptamine receptor 6 5-hydroxytryptamine receptor 7 Adenosine receptor A3 Adrenergic receptor alpha-1 D(1A) dopamine receptor D(1B) dopamine receptor D(2) dopamine receptor D(3) dopamine receptor D(4) dopamine receptor Histamine H1 receptor Histamine H2 Receptor Mu-type opioid receptor Sigma non-opioid intracellular receptor 1 Sodium-dependent dopamine transporter Voltage-gated L-type calcium channel	0	18	0	0	0	0	0	0	4-[4,4-Bis-(4-fluoro-phenyl)-butyl]-piperazine-1-carboxylic acid 2-(4-cyano-phenyl)-ethyl ester CHEMBL326263
BDBM50117271	Bile salt export pump Canalicular multispecific organic anion transporter 1 Canalicular multispecific organic anion transporter 2 Cytochrome P450 2J2 Multidrug resistance-associated protein 4 Potassium channel protein TASK-1 Potassium voltage-gated channel subfamily H member 2 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 7 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 Voltage-gated sodium channel alpha subunit Nav1.1 Voltage-gated sodium channel subunit alpha Nav1.8	2	28	0	0	0	0	0	0	1-(2,6-dimethylphenoxy)-2-propanolamine 1-(2,6-dimethylphenoxy)propan-2-amine 2-(2,6-Dimethyl-phenoxy)-1-methyl-ethylamine 2-(2,6-Dimethyl-phenoxy)-1-methyl-ethylamine(mexiletine) CHEMBL558 MEXILETINE Mexitil
BDBM50132341	5-hydroxytryptamine receptor 1B 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2B 5-hydroxytryptamine receptor 2C 5-hydroxytryptamine receptor 3A 5-hydroxytryptamine receptor 6 5-hydroxytryptamine receptor 7 Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor D(1A) dopamine receptor D(3) dopamine receptor Histamine H2 receptor Muscarinic acetylcholine receptor M5 Serotonin (5-HT) receptor Sigma non-opioid intracellular receptor 1 Sodium-dependent dopamine transporter Translocator protein	18	0	0	0	0	0	0	0	CHEMBL3633757
BDBM50133496	Aldose reductase Aldose reductase (AR) Beta amyloid A4 protein Estradiol 17-beta-dehydrogenase 2 Human immunodeficiency virus type 1 integrase Hyaluronidase Induced myeloid leukemia cell differentiation protein Mcl-1 Integrase Interstitial collagenase Lipoxygenase Matrix metalloproteinase-2 (MMP-2) Proto-oncogene tyrosine-protein kinase Src Reverse transcriptase Transcription factor AP-1 Transthyretin Tyrosinase Tyrosine-protein kinase Fyn Tyrosine-protein kinase Lck	2	27	0	4	0	0	0	0	(2R)-3-(3,4-dihydroxyphenyl)-2-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid (R)-rosmarinic acid CHEMBL324842 Rosmarinic acid, 2 US10688093, Compound rosmarinic acid cid_5281792
BDBM50148690	Cyclin-dependent kinase 1 Cyclooxygenase-1 (COX-1) Cytochrome P450 1A Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 3A Epidermal growth factor receptor Epidermal growth factor receptor and ErbB2 (HER1 and HER2) Hepatocyte growth factor receptor Insulin-like growth factor I receptor MAP kinase p38 Mast/stem cell growth factor receptor Kit Mitogen-activated protein kinase 8 Mitogen-activated protein kinase 9 Proto-oncogene tyrosine-protein kinase Src RAF proto-oncogene serine/threonine-protein kinase Tyrosine-protein kinase ABL1 Vascular endothelial growth factor receptor 2	0	19	0	0	0

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