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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
BDBM103302	Casein kinase II subunit alpha Dual specificity mitogen-activated protein kinase kinase 3 Dual specificity protein kinase CLK2 Dual specificity protein kinase TTK Dual specificty protein kinase CLK1 Haspin (465-798) MAP kinase ERK1 MAP kinase ERK2 Misshapen-like kinase 1 (MINK) Mitogen-activated protein kinase 1 Mitogen-activated protein kinase 10 Mitogen-activated protein kinase 3 Mitogen-activated protein kinase 9 Mitogen-activated protein kinase kinase kinase kinase 4 Serine/threonine-protein kinase 17A Serine/threonine-protein kinase Aurora-C Serine/threonine-protein kinase D1 c-Jun N-terminal kinase 1 truncation (JNK1) (1-363)	0	17	4	0	0	0	0	4	SCH772984 US8546404, 6
BDBM14774	Adenosine receptor A1 Adenosine receptor A2 Adenosine receptor A2b Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B Phosphodiesterase 4 Phosphodiesterase 4 and 5 (PDE4 and PDE5) 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	2	29	0	0	0	0	0	0	3-(cyclopropylmethoxy)-N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)benzamide CHEMBL193240 DAXAS ROF Roflumilast
BDBM18069	Adrenergic Alpha Bile salt export pump Cytochrome P450 2J2 Dihydrofolate Reductase (DHFR) Dihydrofolate Reductase (DHFR) Mutant (F98Y) Dihydrofolate Reductase (DHFR) Mutant (I100L) Dihydrofolate Reductase-Thymidylate Synthase (DHFR-TS) Mutant KICB1 Dihydrofolate reductase Dihydrofolate reductase (DHFR) Dihydrofolate reductase (DfrA) Dihydrofolate reductase (DfrG) Dihydrofolate reductase (DfrK) Dihydrofolate reductase type 1 NH(3)-dependent NAD(+) synthetase Potassium voltage-gated channel subfamily H member 2 Solute carrier family 22 member 1 Trace amine-associated receptor 5 protein-arginine deiminase type-4	49	242	1	1	0	0	0	0	5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine CHEMBL22 TMP Trimethoprim Trimethoprim (TMP)
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 A2 Adenosine receptor A2a and A3 Adenosine receptor A2b Adenosine receptor A3 Adenosine receptors; A1 & A2a Endoplasmin G protein-coupled receptor 80 Sodium/nucleoside cotransporter 2 Transmembrane domain-containing protein TMIGD3	219	22	3	49	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
BDBM22360	Bile salt export pump Carbonic anhydrase 1 Carbonic anhydrase 2 Cyclooxygenase Cyclooxygenase-1 (COX-1) Cyclooxygenase-2 (COX-2) GTP-binding protein (rab7) Gamma-glutamyltranspeptidase 1 Integrin alpha-IIb/beta-3 Liver fatty acid binding protein (rat L-FABP) Prostaglandin G/H synthase (Cyclooxygenase-2) Prostaglandin G/H synthase (cyclooxygenase) Ras-related C3 botulinum toxin substrate 1 Ras-related protein Rab-2A. Solute carrier family 22 member 20 Solute carrier family 22 member 6 cell division cycle 42 (GTP binding protein, 25kDa) ras protein	11	87	0	8	0	0	0	0	2-(acetyloxy)benzoate 2-(acetyloxy)benzoic acid Acetylsalicylic acid Aspirin Endosprin Polopirin Zorprin acetylsalicylate cid_2244
BDBM22889	Adrenergic Alpha Aldehyde oxidase Cytochrome P450 3A HRH3 Histamine H1 receptor Histamine H2 receptor Histamine H4 receptor Histamine receptor (H3) 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
BDBM23409	α-glucosidase 3-oxoacyl-acyl-carrier protein reductase Aldose reductase Aurora kinase B Carbonic anhydrase 1 Carbonic anhydrase 12 Carbonic anhydrase 2 Carbonic anhydrase 4 Carbonic anhydrase 7 Cytochrome P450 1A Cytochrome P450 1A1 Cytochrome P450 1B1 Enoyl-acyl-carrier protein reductase Mitogen-activated protein kinase 10 Mitogen-activated protein kinase 14 Pancreatic lipase Xanthine dehydrogenase/oxidase alpha-Amylase	8	12	0	0	0	0	1	0	3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one CHEMBL379064 Isorhamnetin Isorhamnetin (17)
BDBM23420	12-Lipoxygenase (12-LOX) Aldehyde dehydrogenase (ALDH2) Arachidonate 15-lipoxygenase Aromatase (CYP19) Calcium channel Carbonic anhydrase 1 Carbonic anhydrase 12 Carbonic anhydrase 2 Carbonic anhydrase 4 Carbonic anhydrase 7 Epidermal growth factor receptor Estradiol receptor beta (ERβ) Estrogen receptor Fatty acid synthase Tyrosinase Uridine-5'-diphosphoglucuronosyltransferase 1A1 Xanthine dehydrogenase/oxidase alpha-Amylase	8	22	0	0	0	0	1	0	7,4′-Dihydroxy-isoflavone (3a) 7-hydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one CHEMBL8145 Daidzein US8552057, 7
BDBM25150	Catalytic domain 2 (zCD2) Cytochrome P450 3A Histone Deacetylase 10 (HDAC10) Histone Deacetylase 4 (HDAC4) Mutant (H976Y) Histone deacetylase Histone deacetylase 1 Histone deacetylase 1/6 Histone deacetylase 11 Histone deacetylase 2 Histone deacetylase 3 Histone deacetylase 4 Histone deacetylase 5 Histone deacetylase 6 Histone deacetylase 7 Histone deacetylase 8 Histone deacetylase 9 Leukotriene A4 hydrolase Potassium voltage-gated channel subfamily H member 2	21	32	0	0	0	0	1	0	(2E)-N-hydroxy-3-[3-(phenylsulfamoyl)phenyl]prop-2-enamide Belinosta Belinostat PXD-101 PXD101
BDBM255474	5-Hydroxytryptamine receptor 6 (5-HT6) 5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1B 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C 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 GABA A receptor alpha-1/beta-1/gamma-2 Histamine H1 receptor Serotonin (5-HT) receptor Serotonin receptor (2b and 2c)	22	1	0	1	0	0	0	0	US9481688, 1 US9481688, 3
BDBM25756	ADRB2 Adrenergic receptor beta Beta-1 adrenergic receptor Beta-2 adrenergic receptor Beta-2 adrenergic receptor and beta-3 adrenergic receptor Beta-3 adrenergic receptor Bile salt export pump (BSEP) Cytochrome P450 1A Cytochrome P450 2C19 Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 2J2 Cytochrome P450 3A Neuropeptide Y receptor type 1 Neuropeptide Y receptor type 2 P-glycoprotein 1 Serotonin 1B/1D receptor Sodium channel protein type I I alpha subunit	7	13	10	4	0	0	0	0	(2R,3R)-2,3-dihydroxysuccinic acid;1-(isopropylamino)-3-[4-(2-methoxyethyl)phenoxy]propan-2-ol Betalok CHEMBL13 Metoprolol Spesicor Spesikor metoprolol tartrate {2-hydroxy-3-[4-(2-methoxyethyl)phenoxy]propyl}(propan-2-yl)amine
BDBM26113	Alpha-ketoglutarate-dependent dioxygenase FTO Egl nine homolog 1 Histone Lysine Demethylase Homo sapiens lysine demethylase 2A (KDM2A) Hypoxia-inducible factor 1 (FIH) Hypoxia-inducible factor prolyl hydroxylase 1 Lysine-specific demethylase 3A Lysine-specific demethylase 4A (KDM4A) Lysine-specific demethylase 4C Lysine-specific demethylase 4D Lysine-specific demethylase 5A Lysine-specific demethylase 5A (KDM5A) Lysine-specific demethylase 5B Lysine-specific demethylase 5C (KDM5C) Lysine-specific demethylase 5D (KDM5D) Lysine-specific demethylase 6A (KDM6A) Lysine-specific demethylase 6B Trypanosoma brucei RNA editing ligase 1	3	37	1	0	0	0	0	0	2,4 PDCA cid_10365 pyridine carboxylate, 6a pyridine-2,4-dicarboxylic acid
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	52	0	0	0	0	0	0	0	CHEMBL364571 PhAsO3H2 benzenarsonic acid benzenearsonic acid phenylarsonic acid
BDBM28583	5-Hydroxytryptamine receptor 6 (5-HT6) 5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C 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 Dopamine receptors; D2 & D4 HTR6 Serotonin (5-HT) receptor Serotonin receptor (2b and 2c)	39	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 (5-HT1A) Apoptosis Regulator Bcl-xL Apoptosis regulator Bcl-2 BCL-W Bcl-2-related protein A1 Bile salt export pump D(2) dopamine receptor DNA dC->dU-editing enzyme APOBEC-3G Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor Dopamine receptor Induced myeloid leukemia cell differentiation protein Mcl-1 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	22	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.
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
BDBM35226	5-HT3A Serotonin Receptor 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 1B 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C Alpha-1A adrenergic receptor Alpha-2A adrenergic receptor D(2) dopamine receptor D(3) dopamine receptor Dopamine Transporter (DAT) Monoamine transporters; serotonin & dopamine Norepinephrine transporter Sodium-dependent noradrenaline transporter Sodium-dependent serotonin transporter Transporter adrenergic Alpha2 n-AChR	25	3	0	0	0	0	0	0	(S,S)-reboxetine Reboxetine Vestra
BDBM357013	Aurora kinase B Axin-1/Glycogen synthase kinase-3 beta CDK2/CycE 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 BMX 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 (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
BDBM35938	5-hydroxytryptamine receptor 2C Adrenaline alpha1 Adrenaline alpha2 Bile salt export pump Chloroquine resistance transporter HRH3 Histamine H1 receptor Histamine H4 receptor Lethal(3)malignant brain tumor-like protein 1 (L3MBTL1) Lethal(3)malignant brain tumor-like protein 3 (L3MBTL3) Lethal(3)malignant brain tumor-like protein 4 MBT domain-containing protein 1 (MBTD1) Muscarinic acetylcholine receptor M2 Platelet activating factor receptor Potassium voltage-gated channel subfamily H member 2 Serotonin receptor (2b and 2c) Serotonin receptor 2a and 2c (5HT2A and 5HT2C) Sodium channel protein type I I alpha subunit	25	18	0	0	0	0	0	0	1-(p-chlorophenyl)-1-(2-pyridyl)-3-N,N-dimethylpropylamine 1-(p-chlorophenyl)-1-(2-pyridyl)-3-dimethylaminopropane 3-(p-chlorophenyl)-3-(2-pyridyl)-N,N-dimethylpropylamine 5-HT,N-ACETYL CHEMBL505 CHLORPHENIRAMINE CHLORPHENIRAMINE MALEATE Polaramin Polaramine Polaronil [3H]Chlorphenamine [3H]Chlorpheniramine chlorophenylpyridamine chlorphenamine clorfeniramina d-Chlorpheniramine gamma-(4-chlorophenyl)-N,N-dimethyl-2-pyridinepropanamine gamma-(4-chlorophenyl)-gamma-(2-pyridyl)propyldimethylamine
BDBM40314	3C-like protease Apurinic-apyrimidinic endonuclease 1 (APE-1) BZLF2 DNA recombination protein RecA G-protein coupled receptor 55 Glycogen synthase kinase-3 beta 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
BDBM50004822	5-HT3A Serotonin Receptor 5-hydroxytryptamine receptor 1A (5-HT1A) Adenylate cyclase D(1A) dopamine receptor D(2) dopamine receptor D(3) dopamine receptor DOPAMINE DRD1 DRD2 Dopamine D1 receptor Dopamine D1B Dopamine D2 receptor Dopamine D2 receptor and Serotonin 2a receptor (D2 and 5HT2a) Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor Dopamine D5 receptor Dopamine receptor Serotonin (5-HT) receptor Serotonin receptor 2a and 2c (5HT2A and 5HT2C)	44	5	2	12	0	0	0	0	(R)-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol (R)-7,8-Dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepinium 1-Phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol 1-Phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol(SKF38393) 7,8-Dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepinium(R(+)SKF38393) CHEMBL1467585 CHEMBL24077 R(+)SKF 383931-Phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol SK&F-383933 SK-38393 SK-383933 SKF 38393 SKF 38393 (+)
BDBM50005118	5-hydroxytryptamine receptor 2A ADRB2 Alpha-1A adrenergic receptor D(2) dopamine receptor D(3) dopamine receptor DOPAMINE Dopamine D1 receptor Dopamine D2 receptor Dopamine D2 receptor and Serotonin 2a receptor (D2 and 5HT2a) Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor Dopamine receptor Dopamine receptors; D2 & D4 HTR6 Histamine H1 receptor Muscarinic acetylcholine receptor M2 Serotonin (5-HT) receptor Serotonin receptor 2a and 2c (5HT2A and 5HT2C) adrenergic Alpha2	63	10	2	0	0	0	0	0	(S)-3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide (S)-3,5-dichloro-N-((1-ethylpyrrolidin-2-yl)methyl)-2-hydroxy-6-methoxybenzamide (S)3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide 3,5-Dichloro-N-((S)-1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide 3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide 3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide (raclopride) 3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide(Raclopride) CHEMBL8809 RACLOPRIDE Raclopride;3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide
BDBM50005711	Hdac5 protein Histone Deacetylase 10 (HDAC10) Histone deacetylase Histone deacetylase 1 Histone deacetylase 1/2/3 Histone deacetylase 1/6 Histone deacetylase 11 Histone deacetylase 2 Histone deacetylase 3 Histone deacetylase 3/Nuclear receptor corepressor 2 Histone deacetylase 4 Histone deacetylase 5 Histone deacetylase 6 Histone deacetylase 7 Histone deacetylase 8 Histone deacetylase 8 (HDAC8) Histone deacetylase 9 Leukotriene A4 hydrolase	9	94	2	0	0	0	0	1	CHEBI:46024 GNF-Pf-1011 TRICHOSTATIN Trichostatin A Trichostatin A (TSA) US9265734, TSA
BDBM50007407	5-HT5 5-Hydroxytryptamine receptor 6 (5-HT6) 5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 1B 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2A D(2) dopamine receptor HTR1D HTR6 Serotonin (5-HT) receptor Serotonin 1 (5-HT1) receptor Serotonin 1B/1D receptor Serotonin 2 (5-HT2) receptor Serotonin 3a (5-HT3a)/3b (5-HT3b)/3c (5-HT3c)/3d (5-HT3d)/3e (5-HT3e) receptor Serotonin receptor (2b and 2c) Serotonin receptor 2a and 2b (5HT2A and 5HT2B) Sigma non-opioid intracellular receptor 1	42	2	0	2	0	0	0	0	1-NP 1-Naphthalen-1-yl-piperazine 4-Naphthalen-1-yl-piperazin-1-ium CHEMBL277120
BDBM50038423	Aurora kinase A Aurora kinase B Casein kinase I isoform alpha Epidermal growth factor receptor Focal adhesion kinase 1/vascular endothelial growth factor receptor 3 Glycogen synthase kinase-3 beta Insulin-like growth factor I receptor Mitogen-activated protein kinase 1 Platelet-derived growth factor receptor Protein kinase C alpha type RAC-alpha serine/threonine-protein kinase AKT1 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 and tyrosine-protein kinase TIE-2 (KDR and TIE2) cAMP-dependent protein kinase (PKA) p21-Activated kinase 2 (PAK2)	0	18	2	0	0	0	0	0	CHEMBL3361128
BDBM50057128	5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C Adrenergic receptor alpha-1 Adrenergic receptor beta Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor Beta-2 adrenergic receptor D(2) dopamine receptor DOPAMINE Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor Dopamine Transporter (DAT) Dopamine receptors; D2 & D4 Histamine H1 receptor Norepinephrine Monoamine transporters Serotonin (5-HT) receptor Sodium-dependent serotonin transporter	25	2	0	0	0	0	0	0	(2-Benzofuran-6-yl-ethyl)-((R)-5-methoxy-1,2,3,4-tetrahydro-naphthalen-1-ylmethyl)-methyl-amine A-80426 CHEMBL268258
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 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 c-Jun N-terminal kinase, JNK	0	15	4	0	0	0	0	0	CHEMBL2144409
BDBM50063917	A disintegrin and metalloproteinase with thrombospondin motifs 4 (ADAMTS-4) A disintegrin and metalloproteinase with thrombospondin motifs 5 (ADAMTS-5) ADAM17 Collagenase Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10) Matrix Metalloproteinase-8 (MMP-8) Matrix metalloproteinase 10 Matrix metalloproteinase 15 Matrix metalloproteinase 16 Matrix metalloproteinase 26 Matrix metalloproteinase-1 (MMP1) Matrix metalloproteinase-12 (MMP12) Matrix metalloproteinase-14 (MMP14) Matrix metalloproteinase-20 Matrix metalloproteinase-24 Matrix metalloproteinase-25 Matrix metalloproteinase-7 (MMP7) Stromelysin-1	11	74	0	0	0	0	0	0	(2S,3R)-N(4)-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-N(1),2-dihydroxy-3-(2-methylpropyl)butanediamide CHEMBL279785 cid_119031 marimastat
BDBM50069989	20S proteasome chymotrypsin-like 26S proteosome Alpha-chymotrypsin Beta-chymotrypsin Carbonic anhydrase 1 Carbonic anhydrase 2 Cathepsin (B and K) Cathepsin A (CTSA) Cathepsin G Chymase Cystic fibrosis transmembrane conductance regulator Leukocyte elastase Proteasome Macropain subunit Proteasome component C5 Proteasome subunit beta type-1/beta type-5 Proteasome subunit beta type-7 Proteasome subunit beta type-8 Thrombin and coagulation factor X	10	26	0	1	0	0	0	0	(R)-3-methyl-1-((S)-3-phenyl-2-(pyrazine-2-carboxamido)propanamido)butylboronic acid (R)-3-methyl-1-((S)-3-phenyl-2-(pyrazine-6-carboxamido)propanamido)butylboronic acid BORTEZOMIB CHEMBL325041 Dipeptidyl boronic acid derivative LDP-341 N-[(1R)-1-(DIHYDROXYBORYL)-3-METHYLBUTYL]-N-(PYRAZIN-2-YLCARBONYL)-L-PHENYLALANINAMIDE PS-341 Peptidyl boronic acid derivative Velcade cid_387447
BDBM50094968	5-Hydroxytryptamine receptor 6 (5-HT6) 5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5HT1A) 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C 5-hydroxytryptamine receptor 3A 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 and beta-3 adrenergic receptor Muscarinic acetylcholine receptor M4 Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit Serotonin (5-HT) receptor Serotonin 1B/1D receptor	18	0	0	0	0	0	0	0	3-(1-Methyl-4,5-dihydro-1H-imidazol-2-ylmethyl)-pyridine CHEMBL313631
BDBM50105109	5-Hydroxytryptamine receptor 6 (5-HT6) 5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 2A Adenosine receptor A3 Adrenergic receptor alpha-1 D(1A) dopamine receptor D(2) dopamine receptor D(3) dopamine receptor Dopamine D5 receptor Dopamine receptors; D2 & D4 Histamine H1 receptor Histamine H2 Receptor Monoamine transporters; serotonin & dopamine Mu-type opioid receptor Serotonin (5-HT) receptor Sigma non-opioid intracellular receptor 1 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
BDBM50131346	5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C Adenosine receptor A1/Alpha-2A adrenergic receptor Adrenergic receptor alpha Adrenergic receptor alpha-1 Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor D(2) dopamine receptor D(3) dopamine receptor Dopamine Transporter (DAT) Dopamine receptors; D2 & D4 Histamine H1 receptor Monoamine transporters; serotonin & dopamine Norepinephrine Monoamine transporters Sodium-dependent serotonin transporter	29	0	0	0	0	0	0	0	(3R,3aS)-7,8-Dimethoxy-3-[4-((E)-2-methyl-3-phenyl-allyl)-piperazin-1-ylmethyl]-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole (3R,3aS)-7,8-Dimethoxy-3-[4-(2-methyl-3-phenyl-allyl)-piperazin-1-ylmethyl]-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole CHEMBL91157
BDBM50131347	5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C Adenosine receptor A1/Alpha-2A adrenergic receptor Adrenergic receptor alpha Adrenergic receptor alpha-1 Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor D(2) dopamine receptor D(3) dopamine receptor Dopamine Transporter (DAT) Dopamine receptors; D2 & D4 Histamine H1 receptor Monoamine transporters; serotonin & dopamine Norepinephrine Monoamine transporters Sodium-dependent serotonin transporter	29	0	0	0	0	0	0	0	(3R,3aS)-7,8-Dimethoxy-3-[4-((E)-3-phenyl-but-2-enyl)-piperazin-1-ylmethyl]-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole (3R,3aS)-7,8-Dimethoxy-3-[4-(3-phenyl-but-2-enyl)-piperazin-1-ylmethyl]-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole CHEMBL419316
BDBM50131351	5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C Adenosine receptor A1/Alpha-2A adrenergic receptor Adrenergic receptor alpha Adrenergic receptor alpha-1 Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor D(2) dopamine receptor D(3) dopamine receptor Dopamine Transporter (DAT) Dopamine receptors; D2 & D4 Histamine H1 receptor Monoamine transporters; serotonin & dopamine Norepinephrine Monoamine transporters Sodium-dependent serotonin transporter	26	0	0	0	0	0	0	0	(3R,3aS)-7,8-Dimethoxy-3-(4-naphthalen-2-ylmethyl-piperazin-1-ylmethyl)-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole CHEMBL92860
BDBM50131359	5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1A (5-HT1A) 5-hydroxytryptamine receptor 2A 5-hydroxytryptamine receptor 2C Adenosine receptor A1/Alpha-2A adrenergic receptor Adrenergic receptor alpha Adrenergic receptor alpha-1 Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor D(2) dopamine receptor D(3) dopamine receptor Dopamine Transporter (DAT) Dopamine receptors; D2 & D4 Histamine H1 receptor Monoamine transporters; serotonin & dopamine Norepinephrine Monoamine transporters Sodium-dependent serotonin transporter	29	0	0	0	0	0	0	0	(3R,3aS)-7,8-Dimethoxy-3-[4-((E)-3-phenyl-allyl)-piperazin-1-ylmethyl]-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole (3R,3aS)-7,8-Dimethoxy-3-[4-(3-phenyl-allyl)-piperazin-1-ylmethyl]-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole CHEMBL328114
BDBM50132341	5-Hydroxytryptamine receptor 6 (5-HT6) 5-Hydroxytryptamine receptor 7 (5-HT7) 5-hydroxytryptamine receptor 1B 5-hydroxytryptamine receptor 1D 5-hydroxytryptamine receptor 2C 5-hydroxytryptamine receptor 3A Alpha-2A adrenergic receptor Alpha-2B adrenergic receptor Alpha-2C adrenergic receptor D(1A) dopamine receptor D(3) dopamine receptor Histamine H2 receptor Monoamine transporters; serotonin & dopamine Muscarinic acetylcholine receptor M1/M5 chimeric protein Serotonin (5-HT) receptor Serotonin receptor (2b and 2c) Sigma non-opioid intracellular receptor 1 Translocator protein	18	0	0	0	0	0	0	0	CHEMBL3633757
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 9 Proto-oncogene tyrosine-protein kinase Src RAF proto-oncogene serine/threonine-protein kinase Tyrosine-protein kinase ABL1 Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2) c-Jun N-terminal kinase, JNK	0	19	0	0	0	0	0	0	4-[5-(2-Cyclohexylamino-pyridin-4-yl)-4-(4-fluoro-phenyl)-oxazol-2-yl]-piperidin-4-ol CHEMBL121405
BDBM50148692	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 9 Proto-oncogene tyrosine-protein kinase Src RAF proto-oncogene serine/threonine-protein kinase Tyrosine-protein kinase ABL1 Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2) c-Jun N-terminal kinase, JNK	0	19	0	0	0	0	0	0	CHEMBL120185 Cyclopentyl-{4-[2-(4-fluoro-phenyl)-5-(4-methyl-piperazin-1-yl)-imidazo[4,5-b]pyridin-1-yl]-pyrimidin-2-yl}-amine
BDBM50148694	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 9 Proto-oncogene tyrosine-protein kinase Src RAF proto-oncogene serine/threonine-protein kinase Tyrosine-protein kinase ABL1 Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2) c-Jun N-terminal kinase, JNK	0	19	0	0	0

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