Drug_ID	Drug_Name	Synonyms	Drug_Type	Drug_Group	SMILES	Pubchem_ID	CHMBEL_ID	Associated_Conditions	Confidence_Score	PDB_dt
DB05416	GW-501516	GW 501516	SmallMoleculeDrug	Investigational	CC1=C(CSC2=CC(C)=C(OCC(O)=O)C=C2)SC(=N1)C1=CC=C(C=C1)C(F)(F)F	9803963	CHEMBL38943	NA	0.5862	NA
DB00143	Glutathione	5-L-Glutamyl-L-cysteinylglycine|gamma-L-Glutamyl-L-cysteinyl-glycine|Glutathione|Glutathione-SH|GSH|N-(N-gamma-L-Glutamyl-L-cysteinyl)glycine|Reduced glutathione	SmallMoleculeDrug	Approved;Investigational;Nutraceutical	N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(O)=O)C(O)=O	124886	CHEMBL1543	Irrigation of the ocular surface therapy	0.5613	NA
DB01241	Gemfibrozil	2,2-Dimethyl-5-(2,5-dimethylphenoxy)valeriansaeure|2,2-Dimethyl-5-(2,5-xylyloxy)valeriansaeure|2,2-Dimethyl-5-(2,5-xylyloxy)valeric acid|Gemfibrozil|Gemfibrozilo|Gemfibrozilum	SmallMoleculeDrug	Approved	CC1=CC(OCCCC(C)(C)C(O)=O)=C(C)C=C1	3463	CHEMBL457	Coronary Heart Disease (CHD)|Fredrickson classification type IV Hyperlipidemia|Fredrickson classification type V Hyperlipidemia	0.5124	NA
DB00055	Drotrecogin alfa	Activated protein C|Blood coagulation factor XIV (human)|Drotrecogin alfa (activated)|Drotrecogin alfa (activated), lyophilized|Drotrecogin alfa activated|Drotrecogin alfa, activated|Drotrecogin-alfa|Recombinant human activated protein C (rH-APC)	BiotechDrug	Approved;Investigational;Withdrawn	NA	NA	NA	NA	0.5097	NA
DB01890	N,N-Bis(3-(D-gluconamido)propyl)deoxycholamide	D-Gluconamide, N,N'-((((3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl)imino)di-3,1-propanediyl)bis-|Deoxy-bigchap|N,N-Bis(3-(D-gluconamido)propyl)deoxycholamide|N,N'-((((3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl)imino)di-3,1-propandiyl)bis-D-gluconamide	SmallMoleculeDrug	Experimental	[H][C@@](C)(CCC(=O)N(CCCN=C(O)[C@]([H])(O)[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O)CO)CCCN=C(O)[C@]([H])(O)[C@@]([H])(O)[C@]([H])(O)[C@]([H])(O)CO)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@]([H])(O)CC[C@]4(C)[C@@]3([H])C[C@]([H])(O)[C@]12C	446320	NA	NA	0.4983	NA
DB09064	Ciprofibrate	NA	SmallMoleculeDrug	Approved;Investigational	CC(C)(OC1=CC=C(C=C1)C1CC1(Cl)Cl)C(O)=O	NA	CHEMBL557555	NA	0.4967	NA
DB04557	Arachidonic Acid	NA	SmallMoleculeDrug	Experimental	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O	444899	CHEMBL15594	NA	0.4854	NA
DB09422	Soybean oil	NA	SmallMoleculeDrug	Approved	NA	NA	NA	Total parenteral nutrition therapy	0.4842	NA
DB03796	Palmitic Acid	1-Hexyldecanoic Acid|1-Pentadecanecarboxylic acid|FAT|Hexadecanoate|Hexadecanoic acid|Hexadecoic acid|Hexadecylic acid|Hexaectylic acid|Palmitate|Palmitinic acid|Palmitinsaeure	SmallMoleculeDrug	Approved;Experimental	CCCCCCCCCCCCCCCC(O)=O	985	CHEMBL82293	Dry Skin|Skin Irritation|Skin Rash|Nonvenomous insect bite	0.4667	NA
DB00636	Clofibrate	2-(4-Chlorophenoxy)-2-methylpropanoic acid ethyl ester|2-(p-Chlorophenoxy)-2-methylpropionic acid ethyl ester|alpha-(p-Chlorophenoxy)isobutyric acid, ethyl ester|alpha-p-Chlorophenoxyisobutyryl ethyl ester|Clofibrate|Clofibrato|Clofibratum|ELPI|EPIB|Ethyl 2-(P-chlorophenoxy)isobutyrate|Ethyl chlorophenoxyisobutyrate|Ethyl clofibrate|Lipofacton|Liprin	SmallMoleculeDrug	Approved;Investigational	CCOC(=O)C(C)(C)OC1=CC=C(Cl)C=C1	2796	CHEMBL565	NA	0.4662	NA
DB05188	KD3010	NA	SmallMoleculeDrug	Investigational	NA	NA	NA	NA	0.4541	NA
DB07215	2-METHYL-2-(4-{[({4-METHYL-2-[4-(TRIFLUOROMETHYL)PHENYL]-1,3-THIAZOL-5-YL}CARBONYL)AMINO]METHYL}PHENOXY)PROPANOIC ACID	NA	SmallMoleculeDrug	Experimental	CC1=C(SC(=N1)C1=CC=C(C=C1)C(F)(F)F)C(=O)NCC1=CC=C(OC(C)(C)C(O)=O)C=C1	9956726	CHEMBL219586	NA	0.4521	NA
DB11605	Myrrh	Bola resin|Commiphora molmol resin|Commiphora myrrha gum resin|Commiphora myrrha resin|Commiphora myrrha resin extract|Common myrrh|Hirabol myrrh|Mo yao|Moyao (commiphora molmol)|Moyao (commiphora myrrha)|Myrrh (commiphora molmol)|Myrrh (commiphora myrrha)|Myrrha|Myrrha (commiphora molmol)|Myrrha (commiphora myrrha)	SmallMoleculeDrug	Approved	NA	NA	NA	NA	0.4445	NA
DB01708	Prasterone	3-beta-hydroxy-5-androsten-17-one|3beta-hydroxyandrost-5-en-17-one|3β-hydroxyandrost-5-en-17-one|Dehydroandrosterone|Dehydroepiandrosterone|Dehydroisoandrosterone|DHEA	SmallMoleculeDrug	Approved;Investigational;Nutraceutical	[H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@]([H])(O)CC[C@]12C	5881	CHEMBL90593	NA	0.44	NA
DB04519	Caprylic acid	capryloate|Caprylsaeure|Enantic acid|Kaprylsaeure|n-caprylic acid|n-octanoic acid|n-Octoic acid|n-octylic acid|neo-fat 8|octanoate|octanoic acid|Octic acid|octoic acid|Octylic acid	SmallMoleculeDrug	Approved;Experimental;Investigational	CCCCCCCC(O)=O	379	CHEMBL324846	Total parenteral nutrition therapy	0.4362	NA
DB00013	Urokinase	U-plasminogen activator|uPA|Urokinase-type plasminogen activator precursor	BiotechDrug	Approved;Investigational;Withdrawn	NA	NA	CHEMBL1201420	NA	0.4294	NA
DB00605	Sulindac	(Z)-5-Fluoro-2-methyl-1-((P-(methylsulfinyl)phenyl)methylene)-1H-indene-3-acetic acid|cis-5-Fluoro-2-methyl-1-((4-(methylsulfinyl)phenyl)methylene)-1H-indene-3-acetic acid|cis-5-Fluoro-2-methyl-1-((P-methylsulfinyl)benzylidene)indene-3-acetic acid|Sulindac|Sulindaco|Sulindacum	SmallMoleculeDrug	Approved;Investigational	CC1=C(CC(O)=O)C2=CC(F)=CC=C2\C1=C/C1=CC=C(C=C1)S(C)=O	1548887	CHEMBL15770	Acute Gouty Arthritis|Ankylosing Spondylitis (AS)|Colorectal Polyps|Osteoarthritis (OA)|Rheumatoid Arthritis|Tendonitis exacerbated|Acute Subacromial bursitis|Acute supraspinatus tendinitis	0.415	NA
DB03435	Uridine-5'-Diphosphate	NA	SmallMoleculeDrug	Experimental	O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(=O)OP(O)(O)=O)N1C=CC(=O)NC1=O	6031	CHEMBL130266	NA	0.4089	NA
DB07070	(2S)-2-{3-[({[2-fluoro-4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]-4-methoxybenzyl}butanoic acid	NA	SmallMoleculeDrug	Experimental	[H][C@](CC)(CC1=CC(CNC(=O)C2=C(F)C=C(C=C2)C(F)(F)F)=C(OC)C=C1)C(O)=O	11711595	CHEMBL202609	NA	0.3912	NA
DB00749	Etodolac	(+-)-1,8-Diethyl-1,3,4,9-tetrahydropyrano(3,4-b)indole-1-acetic acid|(1,8-Diethyl-1,3,4,9-tetrahydro-pyrano[3,4-b]indol-1-yl)-acetic acid|1,3,4,9-Tetrahydro-1,8-diethylpyrano(3,4-b)indole-1-acetic acid|1,8-Diethyl-1,3,4,9-tetrahydropyrano(3,4-b)indole-1-acetic acid|1,8-Diethyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-ylacetic acid|Étodolac|Etodolac|Etodolaco|Etodolacum|Etodolic acid|Etodolsäure	SmallMoleculeDrug	Approved;Investigational;Vet approved	CCC1=C2NC3=C(CCOC3(CC)CC(O)=O)C2=CC=C1	3308	CHEMBL622	Juvenile Idiopathic Arthritis (JIA)|Osteoarthritis (OA)|Pain, Acute|Rheumatoid Arthritis	0.3907	NA