Compile Data Set for Download or QSAR

Found 77 hits with Last Name = 'imperiali' and Initial = 'b'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085483 ((2-{(3R,6S)-3-[(1S,2R)-2-Hydroxy-1-((S)-1-{(1S,2R)...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH2+]c2ccc3ccccc3c2)C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C44H60N8O10S/c1-26(2)37(43(59)51-38(27(3)53)42(58)46-21-19-29-13-17-33(18-14-29)52(61)62)49-44(60)39(28(4)54)50-41(57)35-25-63-23-9-5-6-12-36(55)47-34(40(56)48-35)20-22-45-32-16-15-30-10-7-8-11-31(30)24-32/h7-8,10-11,13-18,24,26-28,34-35,37-39,45,53-54H,5-6,9,12,19-23,25H2,1-4H3,(H,46,58)(H,47,55)(H,48,56)(H,49,60)(H,50,57)(H,51,59)/p+1/t27-,28-,34+,35+,37+,38+,39+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085481 (CID44328462 | [2-((3R,6S)-3-{(1S,2R)-2-Hydroxy-1-[...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH2+]c2ccc3ccccc3c2)C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCc1ccccc1 Show InChI InChI=1S/C44H61N7O8S/c1-27(2)37(43(58)51-38(28(3)52)42(57)46-22-20-30-13-7-5-8-14-30)49-44(59)39(29(4)53)50-41(56)35-26-60-24-12-6-9-17-36(54)47-34(40(55)48-35)21-23-45-33-19-18-31-15-10-11-16-32(31)25-33/h5,7-8,10-11,13-16,18-19,25,27-29,34-35,37-39,45,52-53H,6,9,12,17,20-24,26H2,1-4H3,(H,46,57)(H,47,54)(H,48,55)(H,49,59)(H,50,56)(H,51,58)/p+1/t28-,29-,34+,35+,37+,38+,39+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085488 (2-{(3R,6S)-3-[(1S,2R)-2-Hydroxy-1-((S)-1-{(1S,2R)-...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH3+])C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C34H54N8O10S/c1-19(2)27(33(49)41-28(20(3)43)32(48)36-16-14-22-9-11-23(12-10-22)42(51)52)39-34(50)29(21(4)44)40-31(47)25-18-53-17-7-5-6-8-26(45)37-24(13-15-35)30(46)38-25/h9-12,19-21,24-25,27-29,43-44H,5-8,13-18,35H2,1-4H3,(H,36,48)(H,37,45)(H,38,46)(H,39,50)(H,40,47)(H,41,49)/p+1/t20-,21-,24+,25+,27+,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085489 (2-{(3R,6S)-3-[(1S,2R)-1-((S)-1-{(1S,2R)-1-[(S)-1-C...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH3+])C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O Show InChI InChI=1S/C35H55N9O11S/c1-18(2)27(33(51)43-28(19(3)45)34(52)39-24(30(37)48)16-21-9-11-22(12-10-21)44(54)55)41-35(53)29(20(4)46)42-32(50)25-17-56-15-7-5-6-8-26(47)38-23(13-14-36)31(49)40-25/h9-12,18-20,23-25,27-29,45-46H,5-8,13-17,36H2,1-4H3,(H2,37,48)(H,38,47)(H,39,52)(H,40,49)(H,41,53)(H,42,50)(H,43,51)/p+1/t19-,20-,23+,24+,25+,27+,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	37	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085491 (c[Hex-gamma-{N-2-naphthyl}-Dab-Cys]-Thr-val-Thr-Np...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH2+]c2ccc3ccccc3c2)C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O Show InChI InChI=1S/C45H61N9O11S/c1-25(2)37(43(61)53-38(26(3)55)44(62)49-34(40(46)58)22-28-13-17-32(18-14-28)54(64)65)51-45(63)39(27(4)56)52-42(60)35-24-66-21-9-5-6-12-36(57)48-33(41(59)50-35)19-20-47-31-16-15-29-10-7-8-11-30(29)23-31/h7-8,10-11,13-18,23,25-27,33-35,37-39,47,55-56H,5-6,9,12,19-22,24H2,1-4H3,(H2,46,58)(H,48,57)(H,49,62)(H,50,59)(H,51,63)(H,52,60)(H,53,61)/p+1/t26-,27-,33+,34+,35+,37+,38+,39+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43866 (2-amino-4,6-dimethyl-3-oxo-1-N,9-N-bis[(3R,6S,7R,1...) Show SMILES CC(C)[C@H]1NC(=O)[C@@H](NC(=O)c2ccc(C)c3oc4c(C)c(=O)c(N)c(C(=O)N[C@H]5[C@@H](C)OC(=O)[C@H](C(C)C)N(C)C(=O)CN(C)C(=O)[C@@H]6CCCN6C(=O)[C@H](NC5=O)C(C)C)c4nc23)[C@@H](C)OC(=O)[C@H](C(C)C)N(C)C(=O)CN(C)C(=O)[C@@H]2CCCN2C1=O Show InChI InChI=1S/C62H86N12O16/c1-27(2)42-59(84)73-23-17-19-36(73)57(82)69(13)25-38(75)71(15)48(29(5)6)61(86)88-33(11)44(55(80)65-42)67-53(78)35-22-21-31(9)51-46(35)64-47-40(41(63)50(77)32(10)52(47)90-51)54(79)68-45-34(12)89-62(87)49(30(7)8)72(16)39(76)26-70(14)58(83)37-20-18-24-74(37)60(85)43(28(3)4)66-56(45)81/h21-22,27-30,33-34,36-37,42-45,48-49H,17-20,23-26,63H2,1-16H3,(H,65,80)(H,66,81)(H,67,78)(H,68,79)/t33-,34-,36+,37+,42-,43-,44+,45+,48+,49+/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid UniChem Similars	Article PubMed	41	-38.6	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085487 (2-((3R,6S)-3-{(1S,2R)-2-Hydroxy-1-[(S)-1-((1S,2R)-...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH3+])C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCc1ccccc1 Show InChI InChI=1S/C34H55N7O8S/c1-20(2)27(33(48)41-28(21(3)42)32(47)36-17-15-23-11-7-5-8-12-23)39-34(49)29(22(4)43)40-31(46)25-19-50-18-10-6-9-13-26(44)37-24(14-16-35)30(45)38-25/h5,7-8,11-12,20-22,24-25,27-29,42-43H,6,9-10,13-19,35H2,1-4H3,(H,36,47)(H,37,44)(H,38,45)(H,39,49)(H,40,46)(H,41,48)/p+1/t21-,22-,24+,25+,27+,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	44	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085482 (2-[(3R,6S)-3-((1S,2R)-2-Hydroxy-1-{(S)-1-[(1S,2R)-...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH3+])C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCCCc1ccccc1 Show InChI InChI=1S/C36H59N7O8S/c1-22(2)29(35(50)43-30(23(3)44)34(49)38-19-11-10-15-25-13-7-5-8-14-25)41-36(51)31(24(4)45)42-33(48)27-21-52-20-12-6-9-16-28(46)39-26(17-18-37)32(47)40-27/h5,7-8,13-14,22-24,26-27,29-31,44-45H,6,9-12,15-21,37H2,1-4H3,(H,38,49)(H,39,46)(H,40,47)(H,41,51)(H,42,48)(H,43,50)/p+1/t23-,24-,26+,27+,29+,30+,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085490 ((2-{(3R,6S)-3-[(1S,2R)-1-((S)-1-{(1S,2R)-1-[(S)-1-...) Show SMILES CCCCCCCCCC[NH2+]CC[C@@H]1NC(=O)CCCCCSC[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O Show InChI InChI=1S/C45H75N9O11S/c1-6-7-8-9-10-11-12-15-23-47-24-22-33-41(59)50-35(27-66-25-16-13-14-17-36(57)48-33)42(60)52-39(30(5)56)45(63)51-37(28(2)3)43(61)53-38(29(4)55)44(62)49-34(40(46)58)26-31-18-20-32(21-19-31)54(64)65/h18-21,28-30,33-35,37-39,47,55-56H,6-17,22-27H2,1-5H3,(H2,46,58)(H,48,57)(H,49,62)(H,50,59)(H,51,63)(H,52,60)(H,53,61)/p+1/t29-,30-,33+,34+,35+,37+,38+,39+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	61	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43865 (6-formyl-4,7-dihydroxy-9-keto-5H-phenazine-1-carbo...) Show SMILES COC(=O)c1ccc(O)c2nc3c(C=O)c(O)cc(O)c3nc12 Show InChI InChI=1S/C15H10N2O6/c1-23-15(22)6-2-3-8(19)13-11(6)16-14-10(21)4-9(20)7(5-18)12(14)17-13/h2-5,19-21H,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	62	-37.7	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085486 (2-((3R,6S)-3-{(1S,2R)-1-[(S)-1-((1S,2R)-1-Carbamoy...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH3+])C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(N)=O Show InChI InChI=1S/C26H47N7O8S/c1-13(2)19(25(40)32-20(14(3)34)22(28)37)31-26(41)21(15(4)35)33-24(39)17-12-42-11-7-5-6-8-18(36)29-16(9-10-27)23(38)30-17/h13-17,19-21,34-35H,5-12,27H2,1-4H3,(H2,28,37)(H,29,36)(H,30,38)(H,31,41)(H,32,40)(H,33,39)/p+1/t14-,15-,16+,17+,19+,20+,21+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085493 (c[Hex-gamma-{N-1-naphthyl}-Dab-Cys]-Thr-val-Thr-Np...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCCCCCC(=O)N[C@@H](CC[NH2+]c2cccc3ccccc23)C(=O)N1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(cc1)[N+]([O-])=O)C(N)=O Show InChI InChI=1S/C45H61N9O11S/c1-25(2)37(43(61)53-38(26(3)55)44(62)49-34(40(46)58)23-28-16-18-30(19-17-28)54(64)65)51-45(63)39(27(4)56)52-42(60)35-24-66-22-9-5-6-15-36(57)48-33(41(59)50-35)20-21-47-32-14-10-12-29-11-7-8-13-31(29)32/h7-8,10-14,16-19,25-27,33-35,37-39,47,55-56H,5-6,9,15,20-24H2,1-4H3,(H2,46,58)(H,48,57)(H,49,62)(H,50,59)(H,51,63)(H,52,60)(H,53,61)/p+1/t26-,27-,33+,34+,35+,37+,38+,39+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085485 (2-Benzylamino-5-(4-nitro-benzylamino)-pentanoic ac...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNCc1ccc(cc1)[N+]([O-])=O)NCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(N)=O |r| Show InChI InChI=1S/C34H50N8O9/c1-20(2)28(33(48)41-29(21(3)43)31(35)46)40-34(49)30(22(4)44)39-27(45)19-38-32(47)26(37-18-23-9-6-5-7-10-23)11-8-16-36-17-24-12-14-25(15-13-24)42(50)51/h5-7,9-10,12-15,20-22,26,28-30,36-37,43-44H,8,11,16-19H2,1-4H3,(H2,35,46)(H,38,47)(H,39,45)(H,40,49)(H,41,48)/t21-,22-,26+,28+,29+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	154	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085484 (2-Benzylamino-5-(4-methoxy-benzylamino)-pentanoic ...) Show SMILES COc1ccc(CNCCC[C@H](NCc2ccccc2)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(N)=O)cc1 |r| Show InChI InChI=1S/C35H53N7O8/c1-21(2)29(34(48)42-30(22(3)43)32(36)46)41-35(49)31(23(4)44)40-28(45)20-39-33(47)27(38-19-24-10-7-6-8-11-24)12-9-17-37-18-25-13-15-26(50-5)16-14-25/h6-8,10-11,13-16,21-23,27,29-31,37-38,43-44H,9,12,17-20H2,1-5H3,(H2,36,46)(H,39,47)(H,40,45)(H,41,49)(H,42,48)/t22-,23-,27+,29+,30+,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	305	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43863 (3-[[4-amino-6-(2,5-dimethoxyanilino)-5-nitro-pyrim...) Show SMILES COc1ccc(OC)c(Nc2nc(NCCCN(C)C)nc(N)c2[N+]([O-])=O)c1 Show InChI InChI=1S/C17H25N7O4/c1-23(2)9-5-8-19-17-21-15(18)14(24(25)26)16(22-17)20-12-10-11(27-3)6-7-13(12)28-4/h6-7,10H,5,8-9H2,1-4H3,(H4,18,19,20,21,22)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	1.10E+3	-31.2	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43860 (Glycopeptide, 2 | MLS000517385 | N-(4-acetamidophe...) Show SMILES CC(=O)Nc1ccc(NC(=O)c2ccc(Cl)nc2)cc1 Show InChI InChI=1S/C14H12ClN3O2/c1-9(19)17-11-3-5-12(6-4-11)18-14(20)10-2-7-13(15)16-8-10/h2-8H,1H3,(H,17,19)(H,18,20)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	2.50E+3	-29.3	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43864 (2-chloranyl-N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2...) Show SMILES Clc1cc(ccc1C(=O)Nc1ccc(cc1)C1=NCCN1)C(=O)Nc1ccc(cc1)C1=NCCN1 |t:18,34| Show InChI InChI=1S/C26H23ClN6O2/c27-22-15-18(25(34)32-19-6-1-16(2-7-19)23-28-11-12-29-23)5-10-21(22)26(35)33-20-8-3-17(4-9-20)24-30-13-14-31-24/h1-10,15H,11-14H2,(H,28,29)(H,30,31)(H,32,34)(H,33,35)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	4.00E+3	-28.2	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43861 (4-[7-[4-[diethyl(methyl)ammonio]butoxy]-9-keto-flu...) Show SMILES CC[N+](C)(CC)CCCCOc1ccc2-c3ccc(OCCCC[N+](C)(CC)CC)cc3C(=O)c2c1 Show InChI InChI=1S/C31H48N2O3/c1-7-32(5,8-2)19-11-13-21-35-25-15-17-27-28-18-16-26(24-30(28)31(34)29(27)23-25)36-22-14-12-20-33(6,9-3)10-4/h15-18,23-24H,7-14,19-22H2,1-6H3/q+2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	4.50E+3	-28.0	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit (Homo sapiens (Human))	BDBM50085492 (2,5-Bis-benzylamino-pentanoic acid ({1-[1-(1-carba...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNCc1ccccc1)NCc1ccccc1)[C@@H](C)O)C(=O)N[C@@H]([C@H](C)O)C(N)=O |r| Show InChI InChI=1S/C34H51N7O7/c1-21(2)28(33(47)41-29(22(3)42)31(35)45)40-34(48)30(23(4)43)39-27(44)20-38-32(46)26(37-19-25-14-9-6-10-15-25)16-11-17-36-18-24-12-7-5-8-13-24/h5-10,12-15,21-23,26,28-30,36-37,42-43H,11,16-20H2,1-4H3,(H2,35,45)(H,38,46)(H,39,44)(H,40,48)(H,41,47)/t22-,23+,26-,28-,29-,30-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Technology Curated by ChEMBL					Assay Description Inhibition of asparagine-linked glycosylation by oligosaccharyl transferase				Bioorg Med Chem Lett 10: 281-4 (2000) BindingDB Entry DOI: 10.7270/Q2FJ2H95
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43862 (2-(aminocarbonylamino)-N-[4-[(4-methoxyphenyl)sulf...) Show SMILES COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C(CCSC)NC(N)=O)cc2)cc1 Show InChI InChI=1S/C19H24N4O5S2/c1-28-15-7-3-14(4-8-15)23-30(26,27)16-9-5-13(6-10-16)21-18(24)17(11-12-29-2)22-19(20)25/h3-10,17,23H,11-12H2,1-2H3,(H,21,24)(H3,20,22,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	3.40E+4	-23.4	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 1 (Saccharomyces cerevisiae (Baker's yeast))	BDBM43859 (2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfany...) Show SMILES COc1ccc(cc1)-n1cnnc1SCC(=O)Nc1cc(C)on1 Show InChI InChI=1S/C15H15N5O3S/c1-10-7-13(19-23-10)17-14(21)8-24-15-18-16-9-20(15)11-3-5-12(22-2)6-4-11/h3-7,9H,8H2,1-2H3,(H,17,19,21)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	1.00E+5	-20.9	n/a	n/a	n/a	n/a	n/a	7.5	0
Massachusetts Institute of Technology					Assay Description Competition assay using S. cerevisiae oligosaccharyl transferase (OT)with disaccharide donor Dol-P-P-(GlcNAc)2 and the tripeptide substrate Bz-Asn-Le...				Chem Biol 9: 1323-8 (2002) Article DOI: 10.1016/S1074-5521(02)00281-8 BindingDB Entry DOI: 10.7270/Q2736P9D
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326697 ((3S,6S,9S,12S,15S,18S,21S,24S,27S,30S,33S,36S)-18-...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CN1C(=O)c2ccc(cc2C1=O)N(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(O)=O |r| Show InChI InChI=1S/C82H131N21O22/c1-41(2)35-57(72(114)89-44(7)67(109)100-66(46(9)105)82(124)125)94-69(111)53(19-12-15-31-83)90-73(115)58(36-42(3)4)97-78(120)65(45(8)104)99-75(117)60(39-63(88)108)96-71(113)56(29-30-62(87)107)91-68(110)55(21-14-17-33-85)93-77(119)64(43(5)6)98-74(116)59(37-47-23-26-49(106)27-24-47)95-70(112)54(20-13-16-32-84)92-76(118)61-22-18-34-102(61)81(123)52(86)40-103-79(121)50-28-25-48(101(10)11)38-51(50)80(103)122/h23-28,38,41-46,52-61,64-66,104-106H,12-22,29-37,39-40,83-86H2,1-11H3,(H2,87,107)(H2,88,108)(H,89,114)(H,90,115)(H,91,110)(H,92,118)(H,93,119)(H,94,111)(H,95,112)(H,96,113)(H,97,120)(H,98,116)(H,99,117)(H,100,109)(H,124,125)/t44-,45+,46+,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,64-,65-,66-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50287632 (CHEMBL1253325 | PKYVKQNTLKLAT (HA306-318 peptide)) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(O)=O |r| Show InChI InChI=1S/C69H118N18O19/c1-35(2)31-48(63(99)76-38(7)57(93)87-56(40(9)89)69(105)106)81-60(96)45(18-11-14-28-71)78-64(100)49(32-36(3)4)84-68(104)55(39(8)88)86-66(102)51(34-53(74)92)83-62(98)47(25-26-52(73)91)79-59(95)46(19-12-15-29-72)80-67(103)54(37(5)6)85-65(101)50(33-41-21-23-42(90)24-22-41)82-61(97)44(17-10-13-27-70)77-58(94)43-20-16-30-75-43/h21-24,35-40,43-51,54-56,75,88-90H,10-20,25-34,70-72H2,1-9H3,(H2,73,91)(H2,74,92)(H,76,99)(H,77,94)(H,78,100)(H,79,95)(H,80,103)(H,81,96)(H,82,97)(H,83,98)(H,84,104)(H,85,101)(H,86,102)(H,87,93)(H,105,106)/t38-,39+,40+,43-,44-,45-,46-,47-,48-,49-,50-,51-,54-,55-,56-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326699 ((2S,5S,8S,11S,14S,17S,20S,23S,26S)-2-amino-1-(5-(d...) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#7]-1-[#6](=O)-c2ccc(cc2-[#6]-1=O)-[#7](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r| Show InChI InChI=1S/C45H72N14O13S/c1-21(2)17-32(44(71)72)56-37(64)25(6)52-35(62)23(4)50-34(61)22(3)51-36(63)24(5)53-39(66)31(14-16-73-9)55-41(68)33(20-60)57-40(67)30(11-10-15-49-45(47)48)54-38(65)29(46)19-59-42(69)27-13-12-26(58(7)8)18-28(27)43(59)70/h12-13,18,21-25,29-33,60H,10-11,14-17,19-20,46H2,1-9H3,(H,50,61)(H,51,63)(H,52,62)(H,53,66)(H,54,65)(H,55,68)(H,56,64)(H,57,67)(H,71,72)(H4,47,48,49)/t22-,23-,24-,25-,29-,30-,31-,32-,33-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells at acidic pH by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326699 ((2S,5S,8S,11S,14S,17S,20S,23S,26S)-2-amino-1-(5-(d...) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#7]-1-[#6](=O)-c2ccc(cc2-[#6]-1=O)-[#7](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r| Show InChI InChI=1S/C45H72N14O13S/c1-21(2)17-32(44(71)72)56-37(64)25(6)52-35(62)23(4)50-34(61)22(3)51-36(63)24(5)53-39(66)31(14-16-73-9)55-41(68)33(20-60)57-40(67)30(11-10-15-49-45(47)48)54-38(65)29(46)19-59-42(69)27-13-12-26(58(7)8)18-28(27)43(59)70/h12-13,18,21-25,29-33,60H,10-11,14-17,19-20,46H2,1-9H3,(H,50,61)(H,51,63)(H,52,62)(H,53,66)(H,54,65)(H,55,68)(H,56,64)(H,57,67)(H,71,72)(H4,47,48,49)/t22-,23-,24-,25-,29-,30-,31-,32-,33-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326698 ((6S,9S,12S,15S,18S,21S,24S,27S)-1-amino-6-((S)-2-a...) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#7]-1-[#6](=O)-c2cc3ccc(cc3cc2-[#6]-1=O)-[#7](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r| Show InChI InChI=1S/C49H74N14O13S/c1-23(2)17-36(48(75)76)60-41(68)27(6)56-39(66)25(4)54-38(65)24(3)55-40(67)26(5)57-43(70)35(14-16-77-9)59-45(72)37(22-64)61-44(71)34(11-10-15-53-49(51)52)58-42(69)33(50)21-63-46(73)31-19-28-12-13-30(62(7)8)18-29(28)20-32(31)47(63)74/h12-13,18-20,23-27,33-37,64H,10-11,14-17,21-22,50H2,1-9H3,(H,54,65)(H,55,67)(H,56,66)(H,57,70)(H,58,69)(H,59,72)(H,60,68)(H,61,71)(H,75,76)(H4,51,52,53)/t24-,25-,26-,27-,33-,34-,35-,36-,37-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells at acidic pH by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326698 ((6S,9S,12S,15S,18S,21S,24S,27S)-1-amino-6-((S)-2-a...) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#7]-1-[#6](=O)-c2cc3ccc(cc3cc2-[#6]-1=O)-[#7](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r| Show InChI InChI=1S/C49H74N14O13S/c1-23(2)17-36(48(75)76)60-41(68)27(6)56-39(66)25(4)54-38(65)24(3)55-40(67)26(5)57-43(70)35(14-16-77-9)59-45(72)37(22-64)61-44(71)34(11-10-15-53-49(51)52)58-42(69)33(50)21-63-46(73)31-19-28-12-13-30(62(7)8)18-29(28)20-32(31)47(63)74/h12-13,18-20,23-27,33-37,64H,10-11,14-17,21-22,50H2,1-9H3,(H,54,65)(H,55,67)(H,56,66)(H,57,70)(H,58,69)(H,59,72)(H,60,68)(H,61,71)(H,75,76)(H4,51,52,53)/t24-,25-,26-,27-,33-,34-,35-,36-,37-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11.5	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326704 ((4S,7S,10S,13S,16S,19S,22S,25S,28S)-4-acetamido-1-...) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7]-[#6](=O)-c1cc2cc(ccc2cc1-[#6](-[#8])=O)-[#7](-[#6])-[#6])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r| Show InChI InChI=1S/C51H78N14O15S/c1-24(2)18-37(50(79)80)63-43(71)28(6)58-41(69)26(4)56-40(68)25(3)57-42(70)27(5)59-45(73)36(15-17-81-10)62-48(76)39(23-66)64-46(74)35(12-11-16-54-51(52)53)61-47(75)38(60-29(7)67)22-55-44(72)33-21-31-19-32(65(8)9)14-13-30(31)20-34(33)49(77)78/h13-14,19-21,24-28,35-39,66H,11-12,15-18,22-23H2,1-10H3,(H,55,72)(H,56,68)(H,57,70)(H,58,69)(H,59,73)(H,60,67)(H,61,75)(H,62,76)(H,63,71)(H,64,74)(H,77,78)(H,79,80)(H4,52,53,54)/t25-,26-,27-,28-,35-,36-,37-,38-,39-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells at acidic pH by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326703 ((5S,8S,11S,14S,17S,20S,23S,26S,29S)-5-acetamido-1-...) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7]-[#6](=O)-[#6]-c1ccc(cc1-[#6](-[#8])=O)-[#7](-[#6])-[#6])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r| Show InChI InChI=1S/C48H78N14O15S/c1-23(2)18-34(47(76)77)60-41(69)27(6)55-39(67)25(4)53-38(66)24(3)54-40(68)26(5)56-42(70)33(15-17-78-10)59-45(73)36(22-63)61-43(71)32(12-11-16-51-48(49)50)58-44(72)35(57-28(7)64)21-52-37(65)19-29-13-14-30(62(8)9)20-31(29)46(74)75/h13-14,20,23-27,32-36,63H,11-12,15-19,21-22H2,1-10H3,(H,52,65)(H,53,66)(H,54,68)(H,55,67)(H,56,70)(H,57,64)(H,58,72)(H,59,73)(H,60,69)(H,61,71)(H,74,75)(H,76,77)(H4,49,50,51)/t24-,25-,26-,27-,32-,33-,34-,35-,36-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells at acidic pH by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501676 (CHEMBL4064985) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3ccccc3C)c12)C(O)=O Show InChI InChI=1S/C25H25N3O2S/c1-16-8-6-7-11-19(16)14-15-26-23-21-17(2)22(25(29)30)31-24(21)28-20(27-23)13-12-18-9-4-3-5-10-18/h3-11H,12-15H2,1-2H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501686 (CHEMBL4065331) Show SMILES CO[C@H](CNc1nc(CCc2ccc(NC(C)=O)cc2)nc2sc(C(O)=O)c(C)c12)c1ccccc1 |r| Show InChI InChI=1S/C27H28N4O4S/c1-16-23-25(28-15-21(35-3)19-7-5-4-6-8-19)30-22(31-26(23)36-24(16)27(33)34)14-11-18-9-12-20(13-10-18)29-17(2)32/h4-10,12-13,21H,11,14-15H2,1-3H3,(H,29,32)(H,33,34)(H,28,30,31)/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501689 (CHEMBL4104598) Show SMILES CC(=O)Nc1ccc(CCc2nc(NCCc3ccccn3)c3c(C)c(sc3n2)C(O)=O)cc1 Show InChI InChI=1S/C25H25N5O3S/c1-15-21-23(27-14-12-18-5-3-4-13-26-18)29-20(30-24(21)34-22(15)25(32)33)11-8-17-6-9-19(10-7-17)28-16(2)31/h3-7,9-10,13H,8,11-12,14H2,1-2H3,(H,28,31)(H,32,33)(H,27,29,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501668 (CHEMBL4102869) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3cccnc3)c12)C(O)=O Show InChI InChI=1S/C23H22N4O2S/c1-15-19-21(25-13-11-17-8-5-12-24-14-17)26-18(10-9-16-6-3-2-4-7-16)27-22(19)30-20(15)23(28)29/h2-8,12,14H,9-11,13H2,1H3,(H,28,29)(H,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501692 (CHEMBL4095254) Show SMILES COc1cc(CCNc2nc(CCc3ccccc3)nc3sc(C(O)=O)c(C)c23)cc(OC)c1 Show InChI InChI=1S/C26H27N3O4S/c1-16-22-24(27-12-11-18-13-19(32-2)15-20(14-18)33-3)28-21(10-9-17-7-5-4-6-8-17)29-25(22)34-23(16)26(30)31/h4-8,13-15H,9-12H2,1-3H3,(H,30,31)(H,27,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501667 (CHEMBL4086446) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3ccncc3)c12)C(O)=O Show InChI InChI=1S/C23H22N4O2S/c1-15-19-21(25-14-11-17-9-12-24-13-10-17)26-18(8-7-16-5-3-2-4-6-16)27-22(19)30-20(15)23(28)29/h2-6,9-10,12-13H,7-8,11,14H2,1H3,(H,28,29)(H,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501681 (CHEMBL4083946) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3cccc(F)c3)c12)C(O)=O Show InChI InChI=1S/C24H22FN3O2S/c1-15-20-22(26-13-12-17-8-5-9-18(25)14-17)27-19(11-10-16-6-3-2-4-7-16)28-23(20)31-21(15)24(29)30/h2-9,14H,10-13H2,1H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501675 (CHEMBL4094203) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3cccc(C)c3)c12)C(O)=O Show InChI InChI=1S/C25H25N3O2S/c1-16-7-6-10-19(15-16)13-14-26-23-21-17(2)22(25(29)30)31-24(21)28-20(27-23)12-11-18-8-4-3-5-9-18/h3-10,15H,11-14H2,1-2H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501655 (CHEMBL4078589) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3ccccn3)c12)C(O)=O Show InChI InChI=1S/C23H22N4O2S/c1-15-19-21(25-14-12-17-9-5-6-13-24-17)26-18(11-10-16-7-3-2-4-8-16)27-22(19)30-20(15)23(28)29/h2-9,13H,10-12,14H2,1H3,(H,28,29)(H,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501685 (CHEMBL4091581) Show SMILES CO[C@H](CNc1nc(C[C@@H](C)c2ccccc2)nc2sc(C(O)=O)c(C)c12)c1ccccc1 |r| Show InChI InChI=1S/C26H27N3O3S/c1-16(18-10-6-4-7-11-18)14-21-28-24(22-17(2)23(26(30)31)33-25(22)29-21)27-15-20(32-3)19-12-8-5-9-13-19/h4-13,16,20H,14-15H2,1-3H3,(H,30,31)(H,27,28,29)/t16-,20-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501660 (CHEMBL4087428) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3ccc(F)cc3)c12)C(O)=O Show InChI InChI=1S/C24H22FN3O2S/c1-15-20-22(26-14-13-17-7-10-18(25)11-8-17)27-19(12-9-16-5-3-2-4-6-16)28-23(20)31-21(15)24(29)30/h2-8,10-11H,9,12-14H2,1H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501684 (CHEMBL4099461) Show SMILES COc1cccc(CCNc2nc(CCc3ccccc3)nc3sc(C(O)=O)c(C)c23)c1 Show InChI InChI=1S/C25H25N3O3S/c1-16-21-23(26-14-13-18-9-6-10-19(15-18)31-2)27-20(12-11-17-7-4-3-5-8-17)28-24(21)32-22(16)25(29)30/h3-10,15H,11-14H2,1-2H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501687 (CHEMBL4068884) Show SMILES CNc1nc(CCc2cccnc2)nc2sc(C(O)=O)c(C)c12 Show InChI InChI=1S/C16H16N4O2S/c1-9-12-14(17-2)19-11(6-5-10-4-3-7-18-8-10)20-15(12)23-13(9)16(21)22/h3-4,7-8H,5-6H2,1-2H3,(H,21,22)(H,17,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501682 (CHEMBL4101939) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3ccccc3F)c12)C(O)=O Show InChI InChI=1S/C24H22FN3O2S/c1-15-20-22(26-14-13-17-9-5-6-10-18(17)25)27-19(12-11-16-7-3-2-4-8-16)28-23(20)31-21(15)24(29)30/h2-10H,11-14H2,1H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501666 (CHEMBL4105281) Show SMILES COc1ccccc1CCNc1nc(CCc2ccccc2)nc2sc(C(O)=O)c(C)c12 Show InChI InChI=1S/C25H25N3O3S/c1-16-21-23(26-15-14-18-10-6-7-11-19(18)31-2)27-20(13-12-17-8-4-3-5-9-17)28-24(21)32-22(16)25(29)30/h3-11H,12-15H2,1-2H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501654 (CHEMBL4072547) Show SMILES COc1ccc(CCNc2nc(CCc3ccccc3)nc3sc(C(O)=O)c(C)c23)cc1 Show InChI InChI=1S/C25H25N3O3S/c1-16-21-23(26-15-14-18-8-11-19(31-2)12-9-18)27-20(13-10-17-6-4-3-5-7-17)28-24(21)32-22(16)25(29)30/h3-9,11-12H,10,13-15H2,1-2H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501693 (CHEMBL4074801) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3ccc4OCOc4c3)c12)C(O)=O Show InChI InChI=1S/C25H23N3O4S/c1-15-21-23(26-12-11-17-7-9-18-19(13-17)32-14-31-18)27-20(10-8-16-5-3-2-4-6-16)28-24(21)33-22(15)25(29)30/h2-7,9,13H,8,10-12,14H2,1H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501692 (CHEMBL4095254) Show SMILES COc1cc(CCNc2nc(CCc3ccccc3)nc3sc(C(O)=O)c(C)c23)cc(OC)c1 Show InChI InChI=1S/C26H27N3O4S/c1-16-22-24(27-12-11-18-13-19(32-2)15-20(14-18)33-3)28-21(10-9-17-7-5-4-6-8-17)29-25(22)34-23(16)26(30)31/h4-8,13-15H,9-12H2,1-3H3,(H,30,31)(H,27,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Competitive inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assesse...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501674 (CHEMBL4073574) Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3ccc(C)cc3)c12)C(O)=O Show InChI InChI=1S/C25H25N3O2S/c1-16-8-10-19(11-9-16)14-15-26-23-21-17(2)22(25(29)30)31-24(21)28-20(27-23)13-12-18-6-4-3-5-7-18/h3-11H,12-15H2,1-2H3,(H,29,30)(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
UDP-N-acetylbacillosamine N-acetyltransferase (Campylobacter jejuni subsp. jejuni serotype O:2 (s...)	BDBM50501680 (CHEMBL4070686) Show SMILES CO[C@@H](CNc1nc(C[C@@H](C)c2ccccc2)nc2sc(C(O)=O)c(C)c12)c1ccccc1 |r| Show InChI InChI=1S/C26H27N3O3S/c1-16(18-10-6-4-7-11-18)14-21-28-24(22-17(2)23(26(30)31)33-25(22)29-21)27-15-20(32-3)19-12-8-5-9-13-19/h4-13,16,20H,14-15H2,1-3H3,(H,30,31)(H,27,28,29)/t16-,20+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	870	n/a	n/a	n/a	n/a	n/a	n/a
Massachusetts Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...				J Med Chem 60: 2099-2118 (2017) Article DOI: 10.1021/acs.jmedchem.6b01869 BindingDB Entry DOI: 10.7270/Q2JD50TC
					More data for this Ligand-Target Pair
MHC class II antigen (Homo sapiens (Human))	BDBM50326701 ((S)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-3-...) Show SMILES CN(C)c1ccc2C(=O)N(C[C@H](NC(=O)OCC3c4ccccc4-c4ccccc34)C(O)=O)C(=O)c2c1 |r| Show InChI InChI=1S/C28H25N3O6/c1-30(2)16-11-12-21-22(13-16)26(33)31(25(21)32)14-24(27(34)35)29-28(36)37-15-23-19-9-5-3-7-17(19)18-8-4-6-10-20(18)23/h3-13,23-24H,14-15H2,1-2H3,(H,29,36)(H,34,35)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Massachusetts Medical School Curated by ChEMBL					Assay Description Displacement of biotin-HA from recombinant soluble HLA-DR1 expressed in human T2 cells by ELISA				Nat Chem Biol 3: 222-8 (2007) Article DOI: 10.1038/nchembio868 BindingDB Entry DOI: 10.7270/Q2HT2PJR
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 77 total )  |  Next  |  Last  >>

Jump to: