Compile Data Set for Download or QSAR

Found 121 hits of kd data for polymerid = 50006865,8828   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Endoplasmin (Homo sapiens (Human))	BDBM50169936 (CHEMBL3805415) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccccc1OC(C)C Show InChI InChI=1S/C23H25ClN2O5/c1-14(2)31-19-7-5-4-6-15(19)13-26-11-10-25-20(26)9-8-16-21(23(29)30-3)17(27)12-18(28)22(16)24/h4-7,10-12,14,27-28H,8-9,13H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Sus scrofa)	BDBM21220 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a
Sloan-Kettering Curated by ChEMBL					Assay Description Binding affinity to porcine pancreas rough microsomal GRP94 after 1 hr				J Med Chem 58: 3922-43 (2015) Article DOI: 10.1021/acs.jmedchem.5b00197 BindingDB Entry DOI: 10.7270/Q2CC12DD
					More data for this Ligand-Target Pair				3D Structure (crystal)
Endoplasmin (Homo sapiens (Human))	BDBM50169935 (CHEMBL3805249) Show SMILES CCOc1ccccc1Cn1ccnc1CCc1c(Cl)c(O)cc(O)c1C(=O)OC Show InChI InChI=1S/C22H23ClN2O5/c1-3-30-18-7-5-4-6-14(18)13-25-11-10-24-19(25)9-8-15-20(22(28)29-2)16(26)12-17(27)21(15)23/h4-7,10-12,26-27H,3,8-9,13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169935 (CHEMBL3805249) Show SMILES CCOc1ccccc1Cn1ccnc1CCc1c(Cl)c(O)cc(O)c1C(=O)OC Show InChI InChI=1S/C22H23ClN2O5/c1-3-30-18-7-5-4-6-14(18)13-25-11-10-24-19(25)9-8-15-20(22(28)29-2)16(26)12-17(27)21(15)23/h4-7,10-12,26-27H,3,8-9,13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to Grp94 (unknown origin) by fluorescent polarization assay				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113604 BindingDB Entry DOI: 10.7270/Q2GQ72PN
					More data for this Ligand-Target Pair
Endoplasmin (Sus scrofa)	BDBM21220 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Displacement of [3H]NECA from GRP94 in porcine pancreas rough microsomes by liquid scintillation spectrometry				J Med Chem 61: 9513-9533 (2018) Article DOI: 10.1021/acs.jmedchem.8b00800 BindingDB Entry DOI: 10.7270/Q2BK1FZW
					More data for this Ligand-Target Pair				3D Structure (crystal)
Endoplasmin (Homo sapiens (Human))	BDBM50587146 (CHEMBL5073759) Show SMILES CCOC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to Grp94 (unknown origin) by fluorescent polarization assay				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113604 BindingDB Entry DOI: 10.7270/Q2GQ72PN
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50087721 (CHEMBL3426781) Show SMILES CC(C)NCCCn1c(Sc2cc(Cl)cc(Cl)c2)nc2c(N)ncnc12 Show InChI InChI=1S/C17H20Cl2N6S/c1-10(2)21-4-3-5-25-16-14(15(20)22-9-23-16)24-17(25)26-13-7-11(18)6-12(19)8-13/h6-10,21H,3-5H2,1-2H3,(H2,20,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to Grp94 (unknown origin) by fluorescent polarization assay				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113604 BindingDB Entry DOI: 10.7270/Q2GQ72PN
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169939 (CHEMBL3805519) Show SMILES CCCOc1ccccc1Cn1ccnc1CCc1c(Cl)c(O)cc(O)c1C(=O)OC Show InChI InChI=1S/C23H25ClN2O5/c1-3-12-31-19-7-5-4-6-15(19)14-26-11-10-25-20(26)9-8-16-21(23(29)30-2)17(27)13-18(28)22(16)24/h4-7,10-11,13,27-28H,3,8-9,12,14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169707 (CHEMBL3805794) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1oc(C)cc1C Show InChI InChI=1S/C20H21ClN2O5/c1-11-8-12(2)28-16(11)10-23-7-6-22-17(23)5-4-13-18(20(26)27-3)14(24)9-15(25)19(13)21/h6-9,24-25H,4-5,10H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169714 (CHEMBL3804936) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccno1 Show InChI InChI=1S/C17H16ClN3O5/c1-25-17(24)15-11(16(18)13(23)8-12(15)22)2-3-14-19-6-7-21(14)9-10-4-5-20-26-10/h4-8,22-23H,2-3,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM210959 (4-(2-(2-hydroxybenzyl)-1H-pyrrol-1-yl)-2-(((1r,4r)...) Show SMILES NC(=O)c1ccc(cc1NC1CCC(O)CC1)-n1cccc1Cc1ccccc1O |(2.47,4.51,;3.8,3.74,;5.14,4.51,;3.8,2.2,;2.47,1.43,;2.47,-.11,;3.8,-.88,;5.14,-.11,;5.14,1.43,;6.47,2.2,;7.8,1.43,;9.14,2.2,;10.47,1.43,;10.47,-.11,;11.8,-.88,;9.14,-.88,;7.8,-.11,;3.8,-2.42,;2.56,-3.33,;3.03,-4.79,;4.57,-4.79,;5.05,-3.33,;6.51,-2.85,;7.66,-3.88,;7.34,-5.39,;8.48,-6.42,;9.95,-5.95,;10.27,-4.44,;9.12,-3.41,;9.44,-1.9,)| Show InChI InChI=1S/C24H27N3O3/c25-24(30)21-12-9-19(15-22(21)26-17-7-10-20(28)11-8-17)27-13-3-5-18(27)14-16-4-1-2-6-23(16)29/h1-6,9,12-13,15,17,20,26,28-29H,7-8,10-11,14H2,(H2,25,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	440	n/a	n/a	n/a	7.3	n/a
The University of Kansas					Assay Description Assay buffer (25 μL, 20 mM HEPES at pH 7.3, 50 mM KCl, 5 mM MgCl2, 1 mM DTT, 20 mM Na2MoO4, 0.01% NP-40, and 0.5 mg mL−1 BGG) was added to...				ACS Chem Biol 12: 244-253 (2017) Article DOI: 10.1021/acschembio.6b00747 BindingDB Entry DOI: 10.7270/Q20000XQ
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169706 (CHEMBL3804872) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(Cl)o1 Show InChI InChI=1S/C18H16Cl2N2O5/c1-26-18(25)16-11(17(20)13(24)8-12(16)23)3-5-15-21-6-7-22(15)9-10-2-4-14(19)27-10/h2,4,6-8,23-24H,3,5,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50450701 (CHEMBL4168274) Show SMILES NC(=O)c1ccc(cc1N[C@H]1CC[C@H](O)CC1)-n1cccc1Cc1ccccc1O |r,wU:10.10,wD:13.14,(45.82,-28.46,;47.15,-27.69,;47.15,-26.16,;48.49,-28.46,;48.49,-30,;49.83,-30.77,;51.16,-30,;51.16,-28.46,;49.82,-27.69,;49.82,-26.16,;51.16,-25.38,;51.16,-23.84,;52.49,-23.07,;53.83,-23.84,;55.16,-23.07,;53.83,-25.38,;52.49,-26.16,;52.49,-30.77,;52.65,-32.3,;54.15,-32.61,;54.92,-31.28,;53.89,-30.14,;54.29,-28.66,;55.78,-28.26,;56.86,-29.35,;58.35,-28.95,;58.75,-27.47,;57.66,-26.38,;56.17,-26.77,;55.08,-25.68,)| Show InChI InChI=1S/C24H27N3O3/c25-24(30)21-12-9-19(15-22(21)26-17-7-10-20(28)11-8-17)27-13-3-5-18(27)14-16-4-1-2-6-23(16)29/h1-6,9,12-13,15,17,20,26,28-29H,7-8,10-11,14H2,(H2,25,30)/t17-,20-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Displacement of FITC-geldanamycin from GRP94 (unknown origin) after 5 hrs by fluorescence polarization assay				J Med Chem 63: 1798-1822 (2020) Article DOI: 10.1021/acs.jmedchem.9b00940 BindingDB Entry DOI: 10.7270/Q23X8B3C
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169708 (CHEMBL3805768) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1cccs1 Show InChI InChI=1S/C18H17ClN2O4S/c1-25-18(24)16-12(17(19)14(23)9-13(16)22)4-5-15-20-6-7-21(15)10-11-3-2-8-26-11/h2-3,6-9,22-23H,4-5,10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50450704 (CHEMBL560895 | SNX-2112) Show SMILES CC1(C)Cc2c(c(nn2-c2ccc(C(N)=O)c(N[C@H]3CC[C@H](O)CC3)c2)C(F)(F)F)C(=O)C1 |r,wU:18.18,wD:21.22,(-2.35,-2,;-2.38,-.77,;-3.43,-.12,;-1.03,-1.55,;.3,-.77,;.3,.77,;1.76,1.24,;2.66,.02,;1.76,-1.24,;2.24,-2.7,;1.13,-3.76,;1.5,-5.26,;2.98,-5.68,;3.35,-7.18,;4.53,-7.52,;2.46,-8.03,;4.09,-4.62,;5.57,-5.04,;6.68,-3.97,;6.3,-2.47,;7.41,-1.4,;8.89,-1.82,;9.77,-.96,;9.27,-3.32,;8.16,-4.39,;3.72,-3.12,;2.24,2.7,;3.44,2.95,;1.41,3.61,;2.62,3.87,;-1.03,1.55,;-1.03,2.79,;-2.38,.77,)| Show InChI InChI=1S/C23H27F3N4O3/c1-22(2)10-17-19(18(32)11-22)20(23(24,25)26)29-30(17)13-5-8-15(21(27)33)16(9-13)28-12-3-6-14(31)7-4-12/h5,8-9,12,14,28,31H,3-4,6-7,10-11H2,1-2H3,(H2,27,33)/t12-,14-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	n/a	484	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Displacement of FITC-geldanamycin from GRP94 (unknown origin) after 5 hrs by fluorescence polarization assay				J Med Chem 63: 1798-1822 (2020) Article DOI: 10.1021/acs.jmedchem.9b00940 BindingDB Entry DOI: 10.7270/Q23X8B3C
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM21220 ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of FITC-geldanamycin from GRP94 (unknown origin) after 24 hrs by fluorescence polarization assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00509 BindingDB Entry DOI: 10.7270/Q280567M
					More data for this Ligand-Target Pair				3D Structure (crystal)
Endoplasmin (Homo sapiens (Human))	BDBM50169704 (CHEMBL3805027) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccco1 Show InChI InChI=1S/C18H17ClN2O5/c1-25-18(24)16-12(17(19)14(23)9-13(16)22)4-5-15-20-6-7-21(15)10-11-3-2-8-26-11/h2-3,6-9,22-23H,4-5,10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50407975 (CHEMBL519809) Show SMILES CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C11H14N6O4/c1-13-10(20)7-5(18)6(19)11(21-7)17-3-16-4-8(12)14-2-15-9(4)17/h2-3,5-7,11,18-19H,1H3,(H,13,20)(H2,12,14,15)/t5-,6+,7-,11+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of FITC-geldanamycin from GRP94 (unknown origin) after 24 hrs by fluorescence polarization assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00509 BindingDB Entry DOI: 10.7270/Q280567M
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169705 (CHEMBL3805428) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(C)o1 Show InChI InChI=1S/C19H19ClN2O5/c1-11-3-4-12(27-11)10-22-8-7-21-16(22)6-5-13-17(19(25)26-2)14(23)9-15(24)18(13)20/h3-4,7-9,23-24H,5-6,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169712 (CHEMBL3805824) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1cc(Cl)cs1 Show InChI InChI=1S/C18H16Cl2N2O4S/c1-26-18(25)16-12(17(20)14(24)7-13(16)23)2-3-15-21-4-5-22(15)8-11-6-10(19)9-27-11/h4-7,9,23-24H,2-3,8H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	670	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169710 (CHEMBL3804875) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(C)s1 Show InChI InChI=1S/C19H19ClN2O4S/c1-11-3-4-12(27-11)10-22-8-7-21-16(22)6-5-13-17(19(25)26-2)14(23)9-15(24)18(13)20/h3-4,7-9,23-24H,5-6,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM210954 (4-(2-(2-fluorobenzyl)-1H-pyrrol-1-yl)-2-(((1r,4r)-...) Show SMILES NC(=O)c1ccc(cc1NC1CCC(O)CC1)-n1cccc1Cc1ccccc1F |(2.47,4.51,;3.8,3.74,;5.14,4.51,;3.8,2.2,;2.47,1.43,;2.47,-.11,;3.8,-.88,;5.14,-.11,;5.14,1.43,;6.47,2.2,;7.8,1.43,;9.14,2.2,;10.47,1.43,;10.47,-.11,;11.8,-.88,;9.14,-.88,;7.8,-.11,;3.8,-2.42,;2.56,-3.33,;3.03,-4.79,;4.57,-4.79,;5.05,-3.33,;6.51,-2.85,;7.66,-3.88,;7.34,-5.39,;8.48,-6.42,;9.95,-5.95,;10.27,-4.44,;9.12,-3.41,;9.44,-1.9,)| Show InChI InChI=1S/C24H26FN3O2/c25-22-6-2-1-4-16(22)14-18-5-3-13-28(18)19-9-12-21(24(26)30)23(15-19)27-17-7-10-20(29)11-8-17/h1-6,9,12-13,15,17,20,27,29H,7-8,10-11,14H2,(H2,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	720	n/a	n/a	n/a	7.3	n/a
The University of Kansas					Assay Description Assay buffer (25 μL, 20 mM HEPES at pH 7.3, 50 mM KCl, 5 mM MgCl2, 1 mM DTT, 20 mM Na2MoO4, 0.01% NP-40, and 0.5 mg mL−1 BGG) was added to...				ACS Chem Biol 12: 244-253 (2017) Article DOI: 10.1021/acschembio.6b00747 BindingDB Entry DOI: 10.7270/Q20000XQ
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169753 (CHEMBL3805991) Show SMILES CCc1ccsc1Cn1ccnc1CCc1c(Cl)c(O)cc(O)c1C(=O)OC Show InChI InChI=1S/C20H21ClN2O4S/c1-3-12-6-9-28-16(12)11-23-8-7-22-17(23)5-4-13-18(20(26)27-2)14(24)10-15(25)19(13)21/h6-10,24-25H,3-5,11H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169843 (CHEMBL3805286) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(C)cc1 Show InChI InChI=1S/C21H21ClN2O4/c1-13-3-5-14(6-4-13)12-24-10-9-23-18(24)8-7-15-19(21(27)28-2)16(25)11-17(26)20(15)22/h3-6,9-11,25-26H,7-8,12H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	730	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169716 (CHEMBL3805350) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1sccc1C=C Show InChI InChI=1S/C20H19ClN2O4S/c1-3-12-6-9-28-16(12)11-23-8-7-22-17(23)5-4-13-18(20(26)27-2)14(24)10-15(25)19(13)21/h3,6-10,24-25H,1,4-5,11H2,2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169713 (CHEMBL3804981) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1sccc1Cl Show InChI InChI=1S/C18H16Cl2N2O4S/c1-26-18(25)16-10(17(20)13(24)8-12(16)23)2-3-15-21-5-6-22(15)9-14-11(19)4-7-27-14/h4-8,23-24H,2-3,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169784 (CHEMBL3804944) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(Cl)cc1 Show InChI InChI=1S/C20H18Cl2N2O4/c1-28-20(27)18-14(19(22)16(26)10-15(18)25)6-7-17-23-8-9-24(17)11-12-2-4-13(21)5-3-12/h2-5,8-10,25-26H,6-7,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	810	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169934 (CHEMBL3805146) Show SMILES CCc1ccccc1Cn1ccnc1CCc1c(Cl)c(O)cc(O)c1C(=O)OC Show InChI InChI=1S/C22H23ClN2O4/c1-3-14-6-4-5-7-15(14)13-25-11-10-24-19(25)9-8-16-20(22(28)29-2)17(26)12-18(27)21(16)23/h4-7,10-12,26-27H,3,8-9,13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	810	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50051099 (CHEMBL3310671) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccccn1 Show InChI InChI=1S/C16H15ClN2O5/c1-24-16(23)14-9(15(17)11(21)8-10(14)20)5-6-13(22)19-12-4-2-3-7-18-12/h2-4,7-8,20-21H,5-6H2,1H3,(H,18,19,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	820	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Inhibition of recombinant Grp94 (unknown origin) assessed as tracer bound after 24 hrs by fluorescence polarization assay				Bioorg Med Chem 22: 4083-98 (2014) Article DOI: 10.1016/j.bmc.2014.05.075 BindingDB Entry DOI: 10.7270/Q2XK8H77
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM210951 (4-(2-(2-chlorobenzyl)-1H-pyrrol-1-yl)-2-(((1r,4r)-...) Show SMILES NC(=O)c1ccc(cc1NC1CCC(O)CC1)-n1cccc1Cc1ccccc1Cl |(2.47,4.51,;3.8,3.74,;5.14,4.51,;3.8,2.2,;2.47,1.43,;2.47,-.11,;3.8,-.88,;5.14,-.11,;5.14,1.43,;6.47,2.2,;7.8,1.43,;9.14,2.2,;10.47,1.43,;10.47,-.11,;11.8,-.88,;9.14,-.88,;7.8,-.11,;3.8,-2.42,;2.56,-3.33,;3.03,-4.79,;4.57,-4.79,;5.05,-3.33,;6.51,-2.85,;7.66,-3.88,;7.34,-5.39,;8.48,-6.42,;9.95,-5.95,;10.27,-4.44,;9.12,-3.41,;9.44,-1.9,)| Show InChI InChI=1S/C24H26ClN3O2/c25-22-6-2-1-4-16(22)14-18-5-3-13-28(18)19-9-12-21(24(26)30)23(15-19)27-17-7-10-20(29)11-8-17/h1-6,9,12-13,15,17,20,27,29H,7-8,10-11,14H2,(H2,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	830	n/a	n/a	n/a	7.3	n/a
The University of Kansas					Assay Description Assay buffer (25 μL, 20 mM HEPES at pH 7.3, 50 mM KCl, 5 mM MgCl2, 1 mM DTT, 20 mM Na2MoO4, 0.01% NP-40, and 0.5 mg mL−1 BGG) was added to...				ACS Chem Biol 12: 244-253 (2017) Article DOI: 10.1021/acschembio.6b00747 BindingDB Entry DOI: 10.7270/Q20000XQ
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169711 (CHEMBL3805965) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(Cl)s1 Show InChI InChI=1S/C18H16Cl2N2O4S/c1-26-18(25)16-11(17(20)13(24)8-12(16)23)3-5-15-21-6-7-22(15)9-10-2-4-14(19)27-10/h2,4,6-8,23-24H,3,5,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169817 (CHEMBL3805621) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(Br)cc1 Show InChI InChI=1S/C20H18BrClN2O4/c1-28-20(27)18-14(19(22)16(26)10-15(18)25)6-7-17-23-8-9-24(17)11-12-2-4-13(21)5-3-12/h2-5,8-10,25-26H,6-7,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50051100 (CHEMBL3310679) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1nccs1 Show InChI InChI=1S/C14H13ClN2O5S/c1-22-13(21)11-7(12(15)9(19)6-8(11)18)2-3-10(20)17-14-16-4-5-23-14/h4-6,18-19H,2-3H2,1H3,(H,16,17,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.08E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Inhibition of recombinant Grp94 (unknown origin) assessed as tracer bound after 24 hrs by fluorescence polarization assay				Bioorg Med Chem 22: 4083-98 (2014) Article DOI: 10.1016/j.bmc.2014.05.075 BindingDB Entry DOI: 10.7270/Q2XK8H77
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM210949 (4-(2-benzyl-1H-pyrrol-1-yl)-2-(((1r,4r)-4-hydroxyc...) Show SMILES NC(=O)c1ccc(cc1NC1CCC(O)CC1)-n1cccc1Cc1ccccc1 |(2.47,4.51,;3.8,3.74,;5.14,4.51,;3.8,2.2,;2.47,1.43,;2.47,-.11,;3.8,-.88,;5.14,-.11,;5.14,1.43,;6.47,2.2,;7.8,1.43,;9.14,2.2,;10.47,1.43,;10.47,-.11,;11.8,-.88,;9.14,-.88,;7.8,-.11,;3.8,-2.42,;2.56,-3.33,;3.03,-4.79,;4.57,-4.79,;5.05,-3.33,;6.51,-2.85,;7.66,-3.88,;9.12,-3.41,;10.27,-4.44,;9.95,-5.95,;8.48,-6.42,;7.34,-5.39,)| Show InChI InChI=1S/C24H27N3O2/c25-24(29)22-13-10-20(16-23(22)26-18-8-11-21(28)12-9-18)27-14-4-7-19(27)15-17-5-2-1-3-6-17/h1-7,10,13-14,16,18,21,26,28H,8-9,11-12,15H2,(H2,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	1.13E+3	n/a	n/a	n/a	7.3	n/a
The University of Kansas					Assay Description Assay buffer (25 μL, 20 mM HEPES at pH 7.3, 50 mM KCl, 5 mM MgCl2, 1 mM DTT, 20 mM Na2MoO4, 0.01% NP-40, and 0.5 mg mL−1 BGG) was added to...				ACS Chem Biol 12: 244-253 (2017) Article DOI: 10.1021/acschembio.6b00747 BindingDB Entry DOI: 10.7270/Q20000XQ
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50087812 (CHEMBL3426787) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccccc1 Show InChI InChI=1S/C20H19ClN2O4/c1-27-20(26)18-14(19(21)16(25)11-15(18)24)7-8-17-22-9-10-23(17)12-13-5-3-2-4-6-13/h2-6,9-11,24-25H,7-8,12H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	1.14E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM210962 (2-(((1r,4r)-4-hydroxycyclohexyl)amino)-4-(2-(2-met...) Show SMILES COc1ccccc1Cc1cccn1-c1ccc(C(N)=O)c(NC2CCC(O)CC2)c1 |(14.91,.65,;13.44,.18,;13.12,-1.33,;14.27,-2.36,;13.95,-3.87,;12.48,-4.34,;11.34,-3.31,;11.66,-1.8,;10.51,-.77,;9.05,-1.25,;8.57,-2.71,;7.03,-2.71,;6.56,-1.25,;7.8,-.34,;7.8,1.2,;6.47,1.97,;6.47,3.51,;7.8,4.28,;7.8,5.82,;9.14,6.59,;6.47,6.59,;9.14,3.51,;10.47,4.28,;11.8,3.51,;13.14,4.28,;14.47,3.51,;14.47,1.97,;15.8,1.2,;13.14,1.2,;11.8,1.97,;9.14,1.97,)| Show InChI InChI=1S/C25H29N3O3/c1-31-24-7-3-2-5-17(24)15-19-6-4-14-28(19)20-10-13-22(25(26)30)23(16-20)27-18-8-11-21(29)12-9-18/h2-7,10,13-14,16,18,21,27,29H,8-9,11-12,15H2,1H3,(H2,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	1.15E+3	n/a	n/a	n/a	7.3	n/a
The University of Kansas					Assay Description Assay buffer (25 μL, 20 mM HEPES at pH 7.3, 50 mM KCl, 5 mM MgCl2, 1 mM DTT, 20 mM Na2MoO4, 0.01% NP-40, and 0.5 mg mL−1 BGG) was added to...				ACS Chem Biol 12: 244-253 (2017) Article DOI: 10.1021/acschembio.6b00747 BindingDB Entry DOI: 10.7270/Q20000XQ
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50389797 (CHEMBL261482) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(=O)NC1CC1 Show InChI InChI=1S/C13H16N6O4/c14-10-6-11(16-3-15-10)19(4-17-6)13-8(21)7(20)9(23-13)12(22)18-5-1-2-5/h3-5,7-9,13,20-21H,1-2H2,(H,18,22)(H2,14,15,16)/t7-,8+,9-,13+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of FITC-geldanamycin from GRP94 (unknown origin) after 24 hrs by fluorescence polarization assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00509 BindingDB Entry DOI: 10.7270/Q280567M
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169926 (CHEMBL3805121) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccccc1OC Show InChI InChI=1S/C21H21ClN2O5/c1-28-17-6-4-3-5-13(17)12-24-10-9-23-18(24)8-7-14-19(21(27)29-2)15(25)11-16(26)20(14)22/h3-6,9-11,25-26H,7-8,12H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169878 (CHEMBL3806252) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccccc1F Show InChI InChI=1S/C20H18ClFN2O4/c1-28-20(27)18-13(19(21)16(26)10-15(18)25)6-7-17-23-8-9-24(17)11-12-4-2-3-5-14(12)22/h2-5,8-10,25-26H,6-7,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169879 (CHEMBL3805874) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccccc1Cl Show InChI InChI=1S/C20H18Cl2N2O4/c1-28-20(27)18-13(19(22)16(26)10-15(18)25)6-7-17-23-8-9-24(17)11-12-4-2-3-5-14(12)21/h2-5,8-10,25-26H,6-7,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.39E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169875 (CHEMBL3806136) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccc(cc1)C#C Show InChI InChI=1S/C22H19ClN2O4/c1-3-14-4-6-15(7-5-14)13-25-11-10-24-19(25)9-8-16-20(22(28)29-2)17(26)12-18(27)21(16)23/h1,4-7,10-12,26-27H,8-9,13H2,2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50051098 (CHEMBL3310536) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccc(Br)cc1 Show InChI InChI=1S/C17H15BrClNO5/c1-25-17(24)15-11(16(19)13(22)8-12(15)21)6-7-14(23)20-10-4-2-9(18)3-5-10/h2-5,8,21-22H,6-7H2,1H3,(H,20,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Inhibition of recombinant Grp94 (unknown origin) assessed as tracer bound after 24 hrs by fluorescence polarization assay				Bioorg Med Chem 22: 4083-98 (2014) Article DOI: 10.1016/j.bmc.2014.05.075 BindingDB Entry DOI: 10.7270/Q2XK8H77
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169703 (CHEMBL3805526) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccoc1 Show InChI InChI=1S/C18H17ClN2O5/c1-25-18(24)16-12(17(19)14(23)8-13(16)22)2-3-15-20-5-6-21(15)9-11-4-7-26-10-11/h4-8,10,22-23H,2-3,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169877 (CHEMBL3805920) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1cccc(F)c1 Show InChI InChI=1S/C65H97N23O13/c66-26-8-7-17-42(54(67)93)82-61(100)50-21-12-30-88(50)62(101)45(20-11-29-76-65(72)73)85-60(99)49-35-78-51(90)33-48(59(98)84-43(18-9-27-74-63(68)69)56(95)83-44(57(96)87-49)19-10-28-75-64(70)71)86-58(97)47(32-38-13-3-1-4-14-38)81-53(92)37-79-52(91)36-80-55(94)46(31-39-22-24-41(89)25-23-39)77-34-40-15-5-2-6-16-40/h1-6,13-16,22-25,42-50,77,89H,7-12,17-21,26-37,66H2,(H2,67,93)(H,78,90)(H,79,91)(H,80,94)(H,81,92)(H,82,100)(H,83,95)(H,84,98)(H,85,99)(H,86,97)(H,87,96)(H4,68,69,74)(H4,70,71,75)(H4,72,73,76)/t42-,43+,44-,45-,46-,47-,48-,49-,50-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.53E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169941 (CHEMBL3806120) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccccc1C(F)(F)F Show InChI InChI=1S/C21H18ClF3N2O4/c1-31-20(30)18-13(19(22)16(29)10-15(18)28)6-7-17-26-8-9-27(17)11-12-4-2-3-5-14(12)21(23,24)25/h2-5,8-10,28-29H,6-7,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.53E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50051101 (CHEMBL3310680) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1nncs1 Show InChI InChI=1S/C13H12ClN3O5S/c1-22-12(21)10-6(11(14)8(19)4-7(10)18)2-3-9(20)16-13-17-15-5-23-13/h4-5,18-19H,2-3H2,1H3,(H,16,17,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	1.54E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Inhibition of recombinant Grp94 (unknown origin) assessed as tracer bound after 24 hrs by fluorescence polarization assay				Bioorg Med Chem 22: 4083-98 (2014) Article DOI: 10.1016/j.bmc.2014.05.075 BindingDB Entry DOI: 10.7270/Q2XK8H77
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169880 (CHEMBL3804985) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccccc1Br Show InChI InChI=1S/C20H18BrClN2O4/c1-28-20(27)18-13(19(22)16(26)10-15(18)25)6-7-17-23-8-9-24(17)11-12-4-2-3-5-14(12)21/h2-5,8-10,25-26H,6-7,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50051096 (CHEMBL3309866) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccccc1Cl Show InChI InChI=1S/C17H15Cl2NO5/c1-25-17(24)15-9(16(19)13(22)8-12(15)21)6-7-14(23)20-11-5-3-2-4-10(11)18/h2-5,8,21-22H,6-7H2,1H3,(H,20,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.85E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Inhibition of recombinant Grp94 (unknown origin) assessed as tracer bound after 24 hrs by fluorescence polarization assay				Bioorg Med Chem 22: 4083-98 (2014) Article DOI: 10.1016/j.bmc.2014.05.075 BindingDB Entry DOI: 10.7270/Q2XK8H77
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50169709 (CHEMBL3805004) Show SMILES COC(=O)c1c(O)cc(O)c(Cl)c1CCc1nccn1Cc1ccsc1 Show InChI InChI=1S/C18H17ClN2O4S/c1-25-18(24)16-12(17(19)14(23)8-13(16)22)2-3-15-20-5-6-21(15)9-11-4-7-26-10-11/h4-8,10,22-23H,2-3,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.14E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas Curated by ChEMBL					Assay Description Apparent binding affinity to Grp94 (unknown origin) after 24 hrs by fluorescence polarization assay using FITC-GDA as tracer				J Med Chem 59: 3471-88 (2016) Article DOI: 10.1021/acs.jmedchem.6b00085 BindingDB Entry DOI: 10.7270/Q2H133X3
					More data for this Ligand-Target Pair
Endoplasmin (Homo sapiens (Human))	BDBM50100419 ((1S,2R,3S,4R,5S)-4-(6-Amino-purin-9-yl)-2,3-dihydr...) Show SMILES CCNC(=O)[C@@]12C[C@@H]1[C@H]([C@H](O)[C@@H]2O)n1cnc2c(N)ncnc12 Show InChI InChI=1S/C14H18N6O3/c1-2-16-13(23)14-3-6(14)8(9(21)10(14)22)20-5-19-7-11(15)17-4-18-12(7)20/h4-6,8-10,21-22H,2-3H2,1H3,(H,16,23)(H2,15,17,18)/t6-,8-,9+,10+,14+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Displacement of FITC-geldanamycin from GRP94 (unknown origin) after 24 hrs by fluorescence polarization assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00509 BindingDB Entry DOI: 10.7270/Q280567M
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 121 total )  |  Next  |  Last  >>

Jump to: