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Compile Data Set for Download or QSAR

Found 12 hits with Last Name = 'rackham' and Initial = 'a'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226348
PNG
(CHEMBL284705)
Show SMILES CC(C(O)=O)c1ccc2OCc3ccccc3Oc2c1
Show InChI InChI=1S/C16H14O4/c1-10(16(17)18)11-6-7-14-15(8-11)20-13-5-3-2-4-12(13)9-19-14/h2-8,10H,9H2,1H3,(H,17,18)
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n/an/a 100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226339
PNG
(CHEMBL33378)
Show SMILES OC(=O)Cc1ccc2Oc3ccccc3OCc2c1
Show InChI InChI=1S/C15H12O4/c16-15(17)8-10-5-6-12-11(7-10)9-18-13-3-1-2-4-14(13)19-12/h1-7H,8-9H2,(H,16,17)
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n/an/a 100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM17638
PNG
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)
Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
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n/an/a 300n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226341
PNG
(CHEMBL33987)
Show SMILES CC(C(O)=O)c1ccc2Oc3ccccc3COc2c1
Show InChI InChI=1S/C16H14O4/c1-10(16(17)18)11-6-7-14-15(8-11)19-9-12-4-2-3-5-13(12)20-14/h2-8,10H,9H2,1H3,(H,17,18)
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n/an/a 300n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226346
PNG
(CHEMBL34003)
Show SMILES CC(C(=O)OCCNC(C)=O)c1ccc2OCc3ccccc3Oc2c1
Show InChI InChI=1S/C20H21NO5/c1-13(20(23)24-10-9-21-14(2)22)15-7-8-18-19(11-15)26-17-6-4-3-5-16(17)12-25-18/h3-8,11,13H,9-10,12H2,1-2H3,(H,21,22)
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n/an/a 1.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226342
PNG
(CHEMBL285188)
Show SMILES COC(=O)C(C)c1ccc2OCc3ccccc3Oc2c1
Show InChI InChI=1S/C17H16O4/c1-11(17(18)19-2)12-7-8-15-16(9-12)21-14-6-4-3-5-13(14)10-20-15/h3-9,11H,10H2,1-2H3
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n/an/a 1.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226349
PNG
(CHEMBL32961)
Show SMILES OC(=O)Cc1ccc2OCc3ccccc3Oc2c1
Show InChI InChI=1S/C15H12O4/c16-15(17)8-10-5-6-13-14(7-10)19-12-4-2-1-3-11(12)9-18-13/h1-7H,8-9H2,(H,16,17)
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n/an/a 1.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226343
PNG
(CHEMBL32990)
Show SMILES CC(CO)c1ccc2OCc3ccccc3Oc2c1
Show InChI InChI=1S/C16H16O3/c1-11(9-17)12-6-7-15-16(8-12)19-14-5-3-2-4-13(14)10-18-15/h2-8,11,17H,9-10H2,1H3
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n/an/a 1.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226340
PNG
(CHEMBL286802)
Show SMILES OC(=O)Cc1ccc2OCc3ccc(Cl)cc3Oc2c1
Show InChI InChI=1S/C15H11ClO4/c16-11-3-2-10-8-19-12-4-1-9(6-15(17)18)5-14(12)20-13(10)7-11/h1-5,7H,6,8H2,(H,17,18)
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n/an/a 7.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226345
PNG
(CHEMBL33814)
Show SMILES OC(=O)Cc1ccc2Oc3ccccc3COc2c1
Show InChI InChI=1S/C15H12O4/c16-15(17)8-10-5-6-13-14(7-10)18-9-11-3-1-2-4-12(11)19-13/h1-7H,8-9H2,(H,16,17)
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n/an/a 1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226347
PNG
(CHEMBL33527)
Show SMILES OC(=O)Cc1ccc2COc3ccccc3Oc2c1
Show InChI InChI=1S/C15H12O4/c16-15(17)8-10-5-6-11-9-18-12-3-1-2-4-13(12)19-14(11)7-10/h1-7H,8-9H2,(H,16,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1/2


(Ovis aries (Sheep))		BDBM50226344
PNG
(CHEMBL32218)
Show SMILES CC(=O)Nc1ccc2Oc3cc(CC(O)=O)ccc3OCc2c1
Show InChI InChI=1S/C17H15NO5/c1-10(19)18-13-3-5-14-12(8-13)9-22-15-4-2-11(7-17(20)21)6-16(15)23-14/h2-6,8H,7,9H2,1H3,(H,18,19)(H,20,21)
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n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Prostaglandin G/H synthase of ram seminal vesicle microsomes

J Med Chem 29: 1436-41 (1986)


BindingDB Entry DOI: 10.7270/Q2X06974
More data for this
Ligand-Target Pair