TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T10965	P-selectin	B0QPW1	3-Hydroxy-2-(1H-indol-3-ylmethyl)-8-(3-thienyl)quinoline-4-carboxylic acid	Investigative	16100168	C23H16N2O3S	400.5	C1=CC=C2C(=C1)C(=CN2)CC3=C(C(=C4C=CC=C(C4=N3)C5=CSC=C5)C(=O)O)O	IC50 = 380000 nM	Non binder
T10965	P-selectin	B0TF3S	(2R)-2-[(2S,3R,4R,5S,6R)-2-[(2R,3R)-1,4-Dimethoxy-1,4-dioxo-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxybutan-2-yl]oxy-3-hydroxy-6-(hydroxymethyl)-5-(naphthalene-1-carbonyloxy)oxan-4-yl]oxy-3-phenylpropanoic acid	Investigative	71457566	C38H44O18	788.7	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]([C@H](C(=O)OC)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)OC(=O)C3=CC=CC4=CC=CC=C43)O[C@H](CC5=CC=CC=C5)C(=O)O)O)C(=O)OC)O)O)O	IC50 > 1000000 nM	Non binder
T10965	P-selectin	B0YB4M	2-(4-Chlorobenzyl)-8-ethyl-3-hydroxyquinoline-4-carboxylic Acid	Investigative	11152028	C19H16ClNO3	341.8	CCC1=C2C(=CC=C1)C(=C(C(=N2)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 250000 nM	Non binder
T10965	P-selectin	B1DE8J	2-(4-Chlorobenzyl)-3-(methoxycarbonyloxy)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100097	C23H20ClNO5	425.9	COC(=O)OC1=C(N=C2C3=C(CCCC3)C=CC2=C1C(=O)O)CC4=CC=C(C=C4)Cl	IC50 = 400000 nM	Non binder
T10965	P-selectin	B1OR5D	2-[2,6-Dimethyl-4-[2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenoxy]acetic acid	Investigative	71720284	C22H26O9	434.4	CC1=CC(=CC(=C1OCC(=O)O)C)C2=CC=CC=C2O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O	IC50 = 6900000 nM	Non binder
T10965	P-selectin	B21BAL	2-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71717843	C20H22O8	390.4	C1=CC=C(C(=C1)C2=CC=CC(=C2)CC(=O)O)O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O	IC50 = 2600000 nM	Non binder
T10965	P-selectin	B21JIA	3-Hydroxy-2-(thiophen-2-ylmethyl)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	11244687	C19H17NO3S	339.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=CS4)O)C(=O)O	IC50 = 413000 nM	Non binder
T10965	P-selectin	B26KTW	3-Hydroxy-2-phenethyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	11359995	C22H21NO3	347.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CCC4=CC=CC=C4)O)C(=O)O	IC50 = 450000 nM	Non binder
T10965	P-selectin	B2K8HW	2-[3-[5-[4-[4-[3-[1-[4-[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]butanoyl]piperidin-4-yl]propyl]piperidin-1-yl]-4-oxobutyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71716626	C61H78N2O18	1127.3	C1CN(CCC1CCCC2CCN(CC2)C(=O)CCCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)C(=O)CCCC6=CC(=C(C=C6)O[C@@H]7[C@H]([C@@H]([C@@H]([C@H](O7)CO)O)O)O)C8=CC=CC(=C8)CC(=O)O	IC50 = 1000000 nM	Non binder
T10965	P-selectin	B2S0VQ	2-[4-[2-[(2R,3S,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenoxy]acetic acid	Investigative	71718488	C20H22O9	406.4	C1=CC=C(C(=C1)C2=CC=C(C=C2)OCC(=O)O)O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O	IC50 = 20000000 nM	Non binder
T10965	P-selectin	B2YGR7	3-Hydroxy-2-(1H-indol-3-ylmethyl)-8-isopropylquinoline-4-carboxylic acid	Investigative	16100109	C22H20N2O3	360.4	CC(C)C1=CC=CC2=C(C(=C(N=C21)CC3=CNC4=CC=CC=C43)O)C(=O)O	IC50 = 415000 nM	Non binder
T10965	P-selectin	B31ZDF	(S)-2-(2,2-Difluoro-2-((2R,3S,4S,5S,6R)-2,3,4,5-tetrahydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)acetamido)pentanedioic acid	Investigative	46881482	C13H19F2NO11	403.29	C(CC(=O)O)[C@@H](C(=O)O)NC(=O)C([C@]1([C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)(F)F	IC50 = 11000000 nM	Non binder
T10965	P-selectin	B3GJ4X	(2S,4R,5R,6R)-5-Acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S)-5-acetamido-6-hydroxy-2-(hydroxymethyl)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid	Investigative	90664124	C31H52N2O23	820.7	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@H]2[C@@H]([C@@H](OC([C@H]2NC(=O)C)O)CO)O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)O)O	IC50 > 1000000 nM	Non binder
T10965	P-selectin	B3HUJ8	2-[3-[5-[6-[3-[2-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-6-oxohexanoyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71716029	C46H50O18	890.9	C1=CC=C(C(=C1)CC(=O)O)C2=C(C=CC(=C2)C(=O)CCCCC(=O)C3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O	IC50 = 1000000 nM	Non binder
T10965	P-selectin	B3MVX7	2-[3-[4-[6-[3-[3-(Carboxymethoxy)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]hexyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenoxy]acetic acid	Investigative	71716031	C46H54O18	894.9	C1=CC(=CC(=C1)OCC(=O)O)C2=C(C=C(C=C2)CCCCCCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC(=CC=C5)OCC(=O)O)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O	IC50 = 540000 nM	Non binder
T10965	P-selectin	B3TB5J	2-(4-Carbamoylbenzyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo-[h]quinoline-4-carboxylic acid	Investigative	11153082	C22H20N2O4	376.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)C(=O)N)O)C(=O)O	IC50 = 1250000 nM	Non binder
T10965	P-selectin	B3VJI9	3-Hydroxy-2-((5-methoxy-1H-indol-3-yl)methyl)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100086	C24H22N2O4	402.4	COC1=CC2=C(C=C1)NC=C2CC3=C(C(=C4C=CC5=C(C4=N3)CCCC5)C(=O)O)O	IC50 = 400000 nM	Non binder
T10965	P-selectin	B42NLB	3-(2,2-Difluoro-2-((2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)acetamido)benzoic acid	Investigative	46845959	C15H17F2NO8	377.29	C1=CC(=CC(=C1)NC(=O)C([C@H]2[C@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)(F)F)C(=O)O	IC50 = 2500000 nM	Non binder
T10965	P-selectin	B4VNR3	8-Chloro-2-(4-chlorobenzyl)-3-hydroxyquinoline-4-carboxylicacid	Investigative	16100154	C17H11Cl2NO3	348.2	C1=CC2=C(C(=C(N=C2C(=C1)Cl)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 715000 nM	Non binder
T10965	P-selectin	B4WK7Q	2-Benzyl-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	11348172	C21H19NO3	333.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=CC=C4)O)C(=O)O	IC50 = 413000 nM	Non binder
T10965	P-selectin	B59NZH	2-Phenyl-2-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenoxy]acetic acid	Investigative	71717846	C26H26O9	482.5	C1=CC=C(C=C1)C(C(=O)O)OC2=CC=CC(=C2)C3=CC=CC=C3O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O	IC50 = 17000000 nM	Non binder
T10965	P-selectin	B5MX0N	6-Bromo-2-(4-chlorobenzyl)-3-hydroxyquinoline-4-carboxylicacid	Investigative	16100107	C17H11BrClNO3	392.6	C1=CC(=CC=C1CC2=NC3=C(C=C(C=C3)Br)C(=C2O)C(=O)O)Cl	IC50 = 650000 nM	Non binder
T10965	P-selectin	B5OF3I	6-[((R)-(R)-1,3,4,5-Tetrahydroxy-cyclohexanecarbonyl)-amino]-hexanoic acid	Investigative	44399069	C13H23NO7	305.32	C1[C@H](C([C@@H](CC1(C(=O)NCCCCCC(=O)O)O)O)O)O	IC50 > 50000000 nM	Non binder
T10965	P-selectin	B5QD8A	(2R)-2-[(2S,3R,4S,5S,6R)-3-Benzoyloxy-2-[(2R,3R)-1,4-dimethoxy-1,4-dioxo-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxybutan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3-phenylpropanoic acid	Investigative	118714544	C34H42O18	738.7	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]([C@H](C(=O)OC)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@H](CC3=CC=CC=C3)C(=O)O)OC(=O)C4=CC=CC=C4)C(=O)OC)O)O)O	IC50 = 520000 nM	Non binder
T10965	P-selectin	B5QH4V	3-Hydroxy-2-(thiophen-3-ylmethyl)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	11359737	C19H17NO3S	339.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CSC=C4)O)C(=O)O	IC50 = 475000 nM	Non binder
T10965	P-selectin	B5T1UH	2-(4-Chlorobenzyl)-3-hydroxy-8-(thien-3-yl)quinoline-4-carboxylicacid	Investigative	11315434	C21H14ClNO3S	395.9	C1=CC2=C(C(=C(N=C2C(=C1)C3=CSC=C3)CC4=CC=C(C=C4)Cl)O)C(=O)O	IC50 = 225000 nM	Non binder
T10965	P-selectin	B6LP7A	3-Hydroxy-2-phenyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	11232405	C20H17NO3	319.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)C4=CC=CC=C4)O)C(=O)O	IC50 = 550000 nM	Non binder
T10965	P-selectin	B78AWT	2-(4-Chlorobenzyl)-3-hydroxy-8-methylquinoline-4-carboxylic Acid	Investigative	11738934	C18H14ClNO3	327.8	CC1=C2C(=CC=C1)C(=C(C(=N2)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 1000000 nM	Non binder
T10965	P-selectin	B7JU3D	Sodium;[(2S,3S,4S,5S,6S)-2-[(2S,3R,4R,5S,6R)-5,6-dihydroxy-2-(hydroxymethyl)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] sulfate	Investigative	90664125	C18H31NaO18S	590.5	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)OS(=O)(=O)[O-])O)CO)O)O)O)O)O.[Na+]	IC50 = 300000 nM	Non binder
T10965	P-selectin	B7M5RG	5-Acetylamino-2-{3,5-dihydroxy-2-hydroxymethyl-6-[2-hydroxymethyl-4-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-tetrahydro-pyran-3-yloxy]-tetrahydro-pyran-4-yloxy}-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxy-propyl)-tetrahydro-pyran-2-carboxylic acid	Investigative	44387294	C28H47NO21	733.7	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2CCO[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)O)O[C@@]4(C[C@@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)CO)O)O)O	IC50 > 1000000 nM	Non binder
T10965	P-selectin	B7QB4T	Sialyl-Lewis X	Investigative	643990	C31H52N2O23	820.7	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]([C@H](C=O)NC(=O)C)[C@@H]([C@@H](CO)O)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@@]3(C[C@@H]([C@H]([C@@H](O3)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)O)O	IC50 > 1000000 nM	Non binder
T10965	P-selectin	B7QIN8	7-Chloro-2-(4-chlorobenzyl)-3-hydroxyquinoline-4-carboxylicacid	Investigative	16100159	C17H11Cl2NO3	348.2	C1=CC(=CC=C1CC2=NC3=C(C=CC(=C3)Cl)C(=C2O)C(=O)O)Cl	IC50 = 900000 nM	Non binder
T10965	P-selectin	B84FHL	Chembl264987	Investigative	90664162	C47H79N5O25S	1146.2	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)CO)OCCCCCCNC(=O)CCCC[C@H]5[C@@H]6[C@H](CS5)NC(=O)N6)NC(=O)C)O)O)O	IC50 = 600000 nM	Non binder
T10965	P-selectin	B8DS6G	2-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[2-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]ethyl]phenyl]phenyl]acetic acid	Investigative	71717234	C40H44O14	748.8	C1=CC=C(C(=C1)C2=CC=CC(=C2)CCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O	IC50 = 2000000 nM	Non binder
T10965	P-selectin	B8WUQ4	((3R,5R)-1,3,4,5-Tetrahydroxy-cyclohexanecarbonyl)-carbamic acid	Investigative	44399147	C9H15NO7	249.22	C1[C@H](C([C@@H](CC1(C(=O)NCC(=O)O)O)O)O)O	IC50 > 50000000 nM	Non binder
T10965	P-selectin	BA0HT4	2-Methyl-3-[2-(3,4,5-trihydroxy-phenyl)-acetylamino]-benzoic acid	Investigative	16116164	C16H15NO6	317.29	CC1=C(C=CC=C1NC(=O)CC2=CC(=C(C(=C2)O)O)O)C(=O)O	IC50 > 500000 nM	Non binder
T10965	P-selectin	BA31GS	3-Hydroxy-2-((2-methyl-1H-indol-3-yl)methyl)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100088	C24H22N2O3	386.4	CC1=C(C2=CC=CC=C2N1)CC3=C(C(=C4C=CC5=C(C4=N3)CCCC5)C(=O)O)O	IC50 = 270000 nM	Non binder
T10965	P-selectin	BAN36L	(2S,4R,5R,6R)-5-Acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-5-acetamido-6-(6-aminohexoxy)-2-(hydroxymethyl)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid	Investigative	90664165	C37H65N3O23	919.9	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)CO)OCCCCCCN)NC(=O)C)O)O)O	IC50 = 2000000 nM	Non binder
T10965	P-selectin	BAUG58	Sodium;3,5-dihydroxy-2-[5-hydroxy-2-(hydroxymethyl)-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-4-sulfonate	Investigative	44304820	C18H31NaO16S	558.5	CC1C(C(C(C(O1)OC2C(COC(C2OC3C(C(C(C(O3)CO)O)S(=O)(=O)[O-])O)CO)O)O)O)O.[Na+]	IC50 = 300000 nM	Non binder
T10965	P-selectin	BB65LY	Ethoxy-[3-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]propyl]phosphinic acid	Investigative	71719069	C23H31O9P	482.5	CCOP(=O)(CCCC1=CC(=CC=C1)C2=CC=CC=C2O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O)O	IC50 = 12400000 nM	Non binder
T10965	P-selectin	BBH2R5	Sodium;[(2S,3R,4R,5R,6R)-2,4,5-trihydroxy-6-[(2R,3S,4R)-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxan-3-yl] sulfate	Investigative	44387297	C17H29NaO16S	544.5	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2CCO[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)O)OS(=O)(=O)[O-])O)O)CO)O)O)O.[Na+]	IC50 = 560000 nM	Non binder
T10965	P-selectin	BC7X1T	Chembl405132	Investigative	90664166	C41H69N3O26	1020	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)CO)OCCCCCCNC(=O)CCC(=O)O)NC(=O)C)O)O)O	IC50 = 1500000 nM	Non binder
T10965	P-selectin	BD1V0X	2-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]propanoic acid	Investigative	71720285	C21H24O8	404.4	CC(C1=CC=CC(=C1)C2=CC=CC=C2O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)O	IC50 = 20000000 nM	Non binder
T10965	P-selectin	BDQ38S	2-[(4-Chlorophenyl)methyl]-3-phenylmethoxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100099	C28H24ClNO3	457.9	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)Cl)OCC5=CC=CC=C5)C(=O)O	IC50 = 390000 nM	Non binder
T10965	P-selectin	BDV9J6	2-[3-[5-[[4-[4-[[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]phenoxy]phenyl]methyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71720274	C54H54O17	975	C1=CC(=CC(=C1)C2=C(C=CC(=C2)CC3=CC=C(C=C3)OC4=CC=C(C=C4)CC5=CC(=C(C=C5)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O)C7=CC=CC(=C7)CC(=O)O)O[C@@H]8[C@H]([C@@H]([C@@H]([C@H](O8)CO)O)O)O)CC(=O)O	IC50 = 700000 nM	Non binder
T10965	P-selectin	BDY93T	2-[2-([1-Phenethylcarbamoyl-2-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yl)-ethyl]-{3-[4-(4-phenoxy-phenoxy)-phenyl]-propionyl}-amino)-acetylamino]-pentanedioic acid	Investigative	44315290	C45H51N3O13	841.9	CC1C(C(C(C(O1)CC(C(=O)NCCC2=CC=CC=C2)N(CC(=O)NC(CCC(=O)O)C(=O)O)C(=O)CCC3=CC=C(C=C3)OC4=CC=C(C=C4)OC5=CC=CC=C5)O)O)O	IC50 = 283000 nM	Non binder
T10965	P-selectin	BE1RC2	2-(4-Cyano-benzyl)-3-hydroxy-7,8,9,10-tetrahydro-benzo[h]quinoline-4-carboxylic Acid	Investigative	11222068	C22H18N2O3	358.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)C#N)O)C(=O)O	IC50 = 500000 nM	Non binder
T10965	P-selectin	BE2IL1	(5-{2-[(3',4',5'-Trihydroxy-biphenyl-2-carbonyl)-amino]-phenyl}-thiophen-2-yl)-acetic acid	Investigative	16116559	C25H19NO6S	461.5	C1=CC=C(C(=C1)C2=CC(=C(C(=C2)O)O)O)C(=O)NC3=CC=CC=C3C4=CC=C(S4)CC(=O)O	IC50 = 212100 nM	Non binder
T10965	P-selectin	BE7C2K	2-[3-[5-[4-[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]butyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71720272	C44H50O16	834.9	C1=CC(=CC(=C1)C2=C(C=CC(=C2)CCCCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O)CC(=O)O	IC50 = 2500000 nM	Non binder
T10965	P-selectin	BESI18	Chembl446630	Investigative	90664170	C35H62N2O22	862.9	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H](C[C@@H](O4)[C@@H]([C@@H](CO)O)O)O)C(=O)O)O)CO)OCCCCCCN)NC(=O)C)O)O)O	IC50 = 700000 nM	Non binder
T10965	P-selectin	BF8NL3	3-(4-{4-[4-(2-Carboxy-vinyl)-phenyl]-5-[4-(2-dodecylcarbamoyl-vinyl)-phenyl]-1H-imidazol-2-yl}-phenyl)-isoxazole-5-carboxylic acid	Investigative	135536082	C43H46N4O6	714.8	CCCCCCCCCCCCNC(=O)/C=C/C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=C(C=C3)C4=NOC(=C4)C(=O)O)C5=CC=C(C=C5)/C=C/C(=O)O	IC50 = 290000 nM	Non binder
T10965	P-selectin	BFBW05	Sodium;[(2S,3R,4R,5R,6R)-2,4,5-trihydroxy-6-[(2R,3R,4R,5S)-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxan-3-yl] sulfate	Investigative	44387295	C17H29NaO17S	560.5	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](CO[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)O)OS(=O)(=O)[O-])O)O)CO)O)O)O)O.[Na+]	IC50 = 670000 nM	Non binder
T10965	P-selectin	BG3SY5	2-[3-[5-[[3-[[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]phenyl]methyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71717844	C48H50O16	882.9	C1=CC(=CC(=C1)CC2=CC(=C(C=C2)O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O)C4=CC=CC(=C4)CC(=O)O)CC5=CC(=C(C=C5)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O)C7=CC=CC(=C7)CC(=O)O	IC50 = 225000 nM	Non binder
T10965	P-selectin	BG8D3K	2-[4-Methyl-3-[2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenoxy]acetic acid	Investigative	71717847	C21H24O9	420.4	CC1=C(C=C(C=C1)OCC(=O)O)C2=CC=CC=C2O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O	IC50 = 12000000 nM	Non binder
T10965	P-selectin	BGF6K4	2-(4-Chlorobenzyl)-3-hydroxy-8-(trifluoromethyl)quinoline-4-carboxylic acid	Investigative	11234390	C18H11ClF3NO3	381.7	C1=CC2=C(C(=C(N=C2C(=C1)C(F)(F)F)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 325000 nM	Non binder
T10965	P-selectin	BHW9D6	3-Hydroxy-2-(4-(trifluoromethoxy)benzyl)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	11418639	C22H18F3NO4	417.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)OC(F)(F)F)O)C(=O)O	IC50 = 610000 nM	Non binder
T10965	P-selectin	BI31HW	(S)-2-(2,2-Difluoro-2-((2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)acetamido)pentanedioic acid	Investigative	46881517	C13H19F2NO10	387.29	C(CC(=O)O)[C@@H](C(=O)O)NC(=O)C([C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)(F)F	IC50 = 11000000 nM	Non binder
T10965	P-selectin	BI87NQ	2-[3-[5-[[4-[[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]phenyl]methyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71716033	C48H50O16	882.9	C1=CC(=CC(=C1)C2=C(C=CC(=C2)CC3=CC=C(C=C3)CC4=CC(=C(C=C4)O[C@@H]5[C@H]([C@@H]([C@@H]([C@H](O5)CO)O)O)O)C6=CC=CC(=C6)CC(=O)O)O[C@@H]7[C@H]([C@@H]([C@@H]([C@H](O7)CO)O)O)O)CC(=O)O	IC50 = 2000000 nM	Non binder
T10965	P-selectin	BI9OK2	2-((1H-Indol-3-yl)methyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	11234111	C23H20N2O3	372.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CNC5=CC=CC=C54)O)C(=O)O	IC50 = 225000 nM	Non binder
T10965	P-selectin	BIX13F	2-{{2-[6-(4-{2-[2-(2-Ethoxy-ethoxy)-ethoxy]-ethoxy}-butoxymethyl)-3,4,5-trihydroxy-tetrahydro-pyran-2-yl]-acetyl}-[1-(methoxycarbonylmethyl-carbamoyl)-ethyl]-amino}-pentanedioic acid	Investigative	44314839	C31H54N2O17	726.8	CCOCCOCCOCCOCCCCOCC1C(C(C(C(O1)CC(=O)N(C(C)C(=O)NCC(=O)OC)C(CCC(=O)O)C(=O)O)O)O)O	IC50 > 3000000 nM	Non binder
T10965	P-selectin	BJF6V9	2-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[6-[4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]hexyl]phenyl]phenyl]acetic acid	Investigative	71719059	C38H48O14	728.8	C1=CC(=CC(=C1)C2=C(C=CC(=C2)CCCCCCC3=CC=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@@H]5[C@H]([C@@H]([C@@H]([C@H](O5)CO)O)O)O)CC(=O)O	IC50 = 1000000 nM	Non binder
T10965	P-selectin	BJH69N	3-(2,2-Difluoro-2-((2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)acetamido)benzoic acid	Investigative	46881485	C15H17F2NO8	377.29	C1=CC(=CC(=C1)NC(=O)C([C@@H]2[C@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)(F)F)C(=O)O	IC50 = 5000000 nM	Non binder
T10965	P-selectin	BJNA72	8-Bromo-2-(4-chlorobenzyl)-3-hydroxyquinoline-4-carboxylic Acid	Investigative	11486189	C17H11BrClNO3	392.6	C1=CC2=C(C(=C(N=C2C(=C1)Br)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 425000 nM	Non binder
T10965	P-selectin	BJNE45	(2S)-2-[[(3R,5R)-1,3,4,5-Tetrahydroxycyclohexanecarbonyl]amino]propanoic acid	Investigative	44399253	C10H17NO7	263.24	C[C@@H](C(=O)O)NC(=O)C1(C[C@H](C([C@@H](C1)O)O)O)O	IC50 > 50000000 nM	Non binder
T10965	P-selectin	BJU14I	3-Hydroxy-2-(1H-indol-3-yl)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100062	C22H18N2O3	358.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)C4=CNC5=CC=CC=C54)O)C(=O)O	IC50 = 225000 nM	Non binder
T10965	P-selectin	BJV9N0	8-(4-Chlorobenzyl)-7-hydroxy-2,3-dihydro-1H-9-aza-cyclopenta[a]naphthalene-6-carboxylic Acid	Investigative	16100199	C20H16ClNO3	353.8	C1CC2=C(C1)C3=NC(=C(C(=C3C=C2)C(=O)O)O)CC4=CC=C(C=C4)Cl	IC50 = 580000 nM	Non binder
T10965	P-selectin	BK93WV	(2S)-3-Hydroxy-2-[[(3R,5R)-1,3,4,5-tetrahydroxycyclohexanecarbonyl]amino]propanoic acid	Investigative	11680708	C10H17NO8	279.24	C1[C@H](C([C@@H](CC1(C(=O)N[C@@H](CO)C(=O)O)O)O)O)O	IC50 = 19500000 nM	Non binder
T10965	P-selectin	BKE83X	2-(4-Chlorobenzyl)-3-hydroxy-8-(trifluoromethoxy)quinoline-4-carboxylic acid	Investigative	11153727	C18H11ClF3NO4	397.7	C1=CC2=C(C(=C(N=C2C(=C1)OC(F)(F)F)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 550000 nM	Non binder
T10965	P-selectin	BKEC43	2-[3-[5-[7-[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]heptyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71719671	C47H56O16	876.9	C1=CC(=CC(=C1)C2=C(C=CC(=C2)CCCCCCCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O)CC(=O)O	IC50 = 400000 nM	Non binder
T10965	P-selectin	BL13GC	Sodium;[(2S,3R,4R,5R,6R)-2,4,5-trihydroxy-6-[(2R,3S,4R)-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxan-3-yl] hydrogen phosphate	Investigative	44387291	C17H30NaO16P	544.4	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2CCO[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)O)OP(=O)(O)[O-])O)O)CO)O)O)O.[Na+]	IC50 > 1000000 nM	Non binder
T10965	P-selectin	BL82PS	Chembl413369	Investigative	90664160	C49H78N4O26	1139.2	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)CO)OCCCCCCNC(=O)C5CCC(CC5)CN6C(=O)C=CC6=O)NC(=O)C)O)O)O	IC50 = 380000 nM	Non binder
T10965	P-selectin	BLQ54E	3-Acetoxy-2-(4-chlorobenzyl)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100092	C23H20ClNO4	409.9	CC(=O)OC1=C(N=C2C3=C(CCCC3)C=CC2=C1C(=O)O)CC4=CC=C(C=C4)Cl	IC50 = 545000 nM	Non binder
T10965	P-selectin	BN4BW5	2-[3-[2-[(2R,3S,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenoxy]acetic acid	Investigative	71719067	C20H22O9	406.4	C1=CC=C(C(=C1)C2=CC(=CC=C2)OCC(=O)O)O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O	IC50 = 4900000 nM	Non binder
T10965	P-selectin	BN73VI	[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-5-Acetamido-2-(hydroxymethyl)-6-(2-tetradecylhexadecoxy)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] 5-acetamido-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylate	Investigative	71719057	C61H112N2O22	1225.5	CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)CO[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O[C@H]2[C@H]([C@H]([C@H]([C@@H](O2)CO)O)OC(=O)C3CC(C(C(O3)C(C(CO)O)O)NC(=O)C)O)O)O[C@H]4[C@H]([C@H]([C@@H]([C@@H](O4)C)O)O)O)NC(=O)C	IC50 = 250000 nM	Non binder
T10965	P-selectin	BNK51P	2-(Benzofuran-3-ylmethyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100078	C23H19NO4	373.4	C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=COC5=CC=CC=C54)O)C(=O)O	IC50 = 225000 nM	Non binder
T10965	P-selectin	BO1Z2N	2-[3-[5-[5-[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]pentyl]-2-[(2R,3S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71719672	C45H52O16	848.9	C1=CC(=CC(=C1)C2=C(C=CC(=C2)CCCCCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H](C(O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O)CC(=O)O	IC50 = 300000 nM	Non binder
T10965	P-selectin	BO2T8R	(2R)-2-[(2S,3R,4S,5S,6R)-2-[(2R,3R)-1,4-Dimethoxy-1,4-dioxo-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxybutan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3-phenylpropanoic acid	Investigative	71450419	C27H38O17	634.6	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]([C@H](C(=O)OC)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@H](CC3=CC=CC=C3)C(=O)O)O)C(=O)OC)O)O)O	IC50 = 880000 nM	Non binder
T10965	P-selectin	BP35RM	(2S,4R,5R,6R)-5-Acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-5-acetamido-6-[6-[[3-carboxy-4-(3-hydroxy-6-oxoxanthen-9-yl)phenyl]carbamothioylamino]hexoxy]-2-(hydroxymethyl)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid	Investigative	90664161	C58H76N4O28S	1309.3	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)CO)OCCCCCCNC(=S)NC5=CC(=C(C=C5)C6=C7C=CC(=O)C=C7OC8=C6C=CC(=C8)O)C(=O)O)NC(=O)C)O)O)O	IC50 = 900000 nM	Non binder
T10965	P-selectin	BP4Z9N	5-(2-{3,5-Dihydroxy-2-hydroxymethyl-6-[2-hydroxymethyl-4-(2,3,4-trihydroxy-5-methoxy-hexyloxy)-tetrahydro-pyran-3-yloxy]-tetrahydro-pyran-4-yloxy}-acetylamino)-2,4-dihydroxy-6-(1,2,3-trihydroxy-propyl)-tetrahydro-pyran-2-carboxylic acid	Investigative	44387293	C28H47NO22	749.7	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](CO[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)O)O[C@@]4(C[C@@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)CO)O)O)O)O	IC50 > 1000000 nM	Non binder
T10965	P-selectin	BPUJ51	Chembl154747	Investigative	90664171	C35H63N3O22	877.9	C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)N)O)C(=O)O)O)CO)OCCCCCCN)NC(=O)C)O)O)O	IC50 = 1000000 nM	Non binder
T10965	P-selectin	BQG1I4	2-{2-[6-(4-{2-[2-(2-Ethoxy-ethoxy)-ethoxy]-ethoxy}-butoxymethyl)-3,4,5-trihydroxy-tetrahydro-pyran-2-yl]-acetylamino}-pentanedioic acid	Investigative	44315332	C25H45NO14	583.6	CCOCCOCCOCCOCCCCOCC1C(C(C(C(O1)CC(=O)NC(CCC(=O)O)C(=O)O)O)O)O	IC50 > 3000000 nM	Non binder
T10965	P-selectin	BQI15S	2-[(2S,3R,4S,5S,6R)-2-[(2R,3R)-1,4-Dimethoxy-1,4-dioxo-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxybutan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxyacetic acid	Investigative	71462945	C20H32O17	544.5	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]([C@H](C(=O)OC)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)OCC(=O)O)O)C(=O)OC)O)O)O	IC50 > 1000000 nM	Non binder
T10965	P-selectin	BR06JU	3-(2,2-Difluoro-2-((2R,3S,4S,5S,6R)-2,3,4,5-tetrahydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)acetamido)benzoic acid	Investigative	46881483	C15H17F2NO9	393.29	C1=CC(=CC(=C1)NC(=O)C([C@]2([C@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)(F)F)C(=O)O	IC50 = 6500000 nM	Non binder
T10965	P-selectin	BR4W6C	Sodium;[(2S,3R,4R,5R,6R)-6-[(2R,3S,4R,5S)-5-acetamido-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-2,4,5-trihydroxyoxan-3-yl] sulfate	Investigative	44387278	C19H32NNaO17S	601.5	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](CO[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)O)OS(=O)(=O)[O-])O)O)CO)NC(=O)C)O)O)O.[Na+]	IC50 > 1000000 nM	Non binder
T10965	P-selectin	BSDW34	(3R,5R)-3,4,5-Trihydroxy-1-[[4-[2-(trifluoromethyl)phenyl]phenyl]methoxy]cyclohexane-1-carboxylic acid	Investigative	11201127	C21H21F3O6	426.4	C1[C@H](C([C@@H](CC1(C(=O)O)OCC2=CC=C(C=C2)C3=CC=CC=C3C(F)(F)F)O)O)O	IC50 = 10000000 nM	Non binder
T10965	P-selectin	BSV26W	3-Hydroxy-7,8-dimethyl-2-phenylquinoline-4-carboxylic acid	Investigative	16099936	C18H15NO3	293.3	CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)O)O)C3=CC=CC=C3)C	IC50 = 1500000 nM	Non binder
T10965	P-selectin	BT50PR	2-[3-[2-[(2R,3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic Acid	Investigative	9977686	C20H22O8	390.4	C1=CC=C(C(=C1)C2=CC=CC(=C2)CC(=O)O)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O	IC50 > 500000 nM	Non binder
T10965	P-selectin	BT64OC	2-((5-Chloro-1H-indol-3-yl)methyl)-3-hydroxy-8-(trifluoromethyl)quinoline-4-carboxylic acid	Investigative	16100113	C20H12ClF3N2O3	420.8	C1=CC2=C(C(=C(N=C2C(=C1)C(F)(F)F)CC3=CNC4=C3C=C(C=C4)Cl)O)C(=O)O	IC50 = 250000 nM	Non binder
T10965	P-selectin	BTD09A	2-(4-Chlorobenzyl)-3-hydroxy-9-(isopropylsulfonyl)-7,8,9,10-tetrahydro-1,9-phenanthroline-4-carboxylic acid	Investigative	11236859	C23H23ClN2O5S	475	CC(C)S(=O)(=O)N1CCC2=C(C1)C3=NC(=C(C(=C3C=C2)C(=O)O)O)CC4=CC=C(C=C4)Cl	IC50 = 500000 nM	Non binder
T10965	P-selectin	BU02FZ	2-(4-Chlorobenzyl)-3-hydroxy-9-(methylsulfonyl)-7,8,9,10-tetrahydro-1,9-phenanthroline-4-carboxylic acid	Investigative	11453647	C21H19ClN2O5S	446.9	CS(=O)(=O)N1CCC2=C(C1)C3=NC(=C(C(=C3C=C2)C(=O)O)O)CC4=CC=C(C=C4)Cl	IC50 = 625000 nM	Non binder
T10965	P-selectin	BU0QV6	2-[3-[5-[3-[3-[3-[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propylsulfanyl]propylsulfanyl]propyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71717230	C49H60O16S2	969.1	C1=CC(=CC(=C1)C2=C(C=CC(=C2)CCCSCCCSCCCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)O[C@@H]6[C@H]([C@@H]([C@@H]([C@H](O6)CO)O)O)O)CC(=O)O	IC50 = 500000 nM	Non binder
T10965	P-selectin	BU1V2D	2-[[4-[2-[(2R,3S,4R,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]benzoyl]amino]butanedioic acid	Investigative	71717849	C23H25NO11	491.4	C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)NC(CC(=O)O)C(=O)O)O[C@@H]3[C@H]([C@@H]([C@@H]([C@H](O3)CO)O)O)O	IC50 = 2000000 nM	Non binder
T10965	P-selectin	BU79CE	(S)-2-(2,2-Difluoro-2-((2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)acetamido)pentanedioic acid	Investigative	46881484	C13H19F2NO10	387.29	C(CC(=O)O)[C@@H](C(=O)O)NC(=O)C([C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)(F)F	IC50 = 3000000 nM	Non binder
T10965	P-selectin	BU9W7J	(2S,4S,5R,6R)-5-Acetamido-2-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-1,2-dihydroxy-6-oxo-4-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid	Investigative	73354415	C31H52N2O23	820.7	C[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)O[C@H]([C@H](C=O)NC(=O)C)[C@H]([C@@H](CO)O)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@@]3(C[C@@H]([C@H]([C@@H](O3)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)O)O	IC50 > 5000000 nM	Non binder
T10965	P-selectin	BUN1D5	8-(Sec-butyl)-2-(4-chlorobenzyl)-3-hydroxyquinoline-4-carboxylic Acid	Investigative	16100148	C21H20ClNO3	369.8	CCC(C)C1=CC=CC2=C(C(=C(N=C21)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 300000 nM	Non binder
T10965	P-selectin	BV4ND3	2-[3-[5-[6-[3-[2-(Carboxymethyl)phenyl]-4-hydroxyphenyl]hexyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid	Investigative	71717231	C40H44O11	700.8	C1=CC=C(C(=C1)CC(=O)O)C2=C(C=CC(=C2)CCCCCCC3=CC(=C(C=C3)O[C@@H]4[C@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=CC(=C5)CC(=O)O)O	IC50 = 2000000 nM	Non binder
T10965	P-selectin	BVKT14	(2S)-3-Methyl-2-[[(3R,5R)-1,3,4,5-tetrahydroxycyclohexanecarbonyl]amino]pentanoic acid	Investigative	11558561	C13H23NO7	305.32	CCC(C)[C@@H](C(=O)O)NC(=O)C1(C[C@H](C([C@@H](C1)O)O)O)O	IC50 = 19000000 nM	Non binder
T10965	P-selectin	BW98QN	(1S,3R,4S,5R)-4-Acetamido-1-[(2S,3S,4S,5R,6S)-2-[(2S,3S,4R,5S,6R)-5-acetamido-6-hydroxy-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3-hydroxy-5-[(1S,2R)-1,2,3-trihydroxypropyl]cyclohexane-1-carboxylic acid	Investigative	90664222	C32H54N2O22	818.8	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O[C@]4(C[C@H]([C@@H]([C@@H](C4)O)NC(=O)C)[C@@H]([C@@H](CO)O)O)C(=O)O)O)CO)O)NC(=O)C)O)O)O	IC50 = 12000000 nM	Non binder
T10965	P-selectin	BWIU31	2-(4-Chlorobenzyl)-3-(isobutoxycarbonyloxy)-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid	Investigative	16100098	C26H26ClNO5	467.9	CC(C)COC(=O)OC1=C(N=C2C3=C(CCCC3)C=CC2=C1C(=O)O)CC4=CC=C(C=C4)Cl	IC50 = 250000 nM	Non binder
T10965	P-selectin	BWN09J	4-[((3R,5R)-1,3,4,5-Tetrahydroxy-cyclohexanecarbonyl)-amino]-butyric acid	Investigative	44399068	C11H19NO7	277.27	C1[C@H](C([C@@H](CC1(C(=O)NCCCC(=O)O)O)O)O)O	IC50 = 40000000 nM	Non binder
T10965	P-selectin	BYKE97	4-[(R)-2-Hexadecanoylamino-3-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-propionylamino]-4-methylcarbamoyl-butyric acid	Investigative	44356617	C31H57N3O10	631.8	CCCCCCCCCCCCCCCC(=O)N[C@H](COC1C(C(C(C(O1)C)O)O)O)C(=O)NC(CCC(=O)O)C(=O)NC	IC50 = 250000 nM	Non binder
T10965	P-selectin	BZ28RF	2-(4-Chlorobenzyl)-3-hydroxy-8-isopropylquinoline-4-carboxylicacid	Investigative	16100104	C20H18ClNO3	355.8	CC(C)C1=CC=CC2=C(C(=C(N=C21)CC3=CC=C(C=C3)Cl)O)C(=O)O	IC50 = 225000 nM	Non binder
T10965	P-selectin	BZB2F1	(S)-2-[((3R,5R)-1,3,4,5-Tetrahydroxy-cyclohexanecarbonyl)-amino]-pentanedioic acid	Investigative	44399232	C12H19NO9	321.28	C1[C@H](C([C@@H](CC1(C(=O)N[C@@H](CCC(=O)O)C(=O)O)O)O)O)O	IC50 = 21000000 nM	Non binder
T10965	P-selectin	D00YPH	3-hydroxy-2-phenylquinoline-4-carboxylic acid	Investigative	10239	C16H11NO3	265.26	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2O)C(=O)O	IC50 = 6500000 nM	Non binder