Compile Data Set for Download or QSAR

Found 152 hits Enz. Inhib. hit(s) with all data for entry = 4274   

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
Plectin (Homo sapiens (Human))	BDBM50094893 (1-Amino-4-hydroxy-anthraquinone | 1-hydroxy-4-amin...) Show SMILES Nc1ccc(O)c2C(=O)c3ccccc3C(=O)c12 Show InChI InChI=1S/C14H9NO3/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,16H,15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	1.52E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM60303 (4-phenyl-N-[4-[(4-sulfamoylphenyl)sulfamoyl]phenyl...) Show SMILES NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2)cc1 Show InChI InChI=1S/C25H21N3O5S2/c26-34(30,31)23-14-12-22(13-15-23)28-35(32,33)24-16-10-21(11-17-24)27-25(29)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-17,28H,(H,27,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54772 (MLS000936640 | SMR000621111 | cid_5052536) Show SMILES OC(=O)CCCNc1cc(N2CCN(CC2)C(=O)c2ccco2)c2noc3-c4ccccc4C(=O)c1c23 Show InChI InChI=1S/C27H24N4O6/c32-21(33)8-3-9-28-18-15-19(30-10-12-31(13-11-30)27(35)20-7-4-14-36-20)24-23-22(18)25(34)16-5-1-2-6-17(16)26(23)37-29-24/h1-2,4-7,14-15,28H,3,8-13H2,(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	4.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54944 (3-[(E)-(5-chloro-2-hydroxyphenyl)diazenyl]-4,5-dih...) Show SMILES Oc1ccc(Cl)cc1N=Nc1c(O)c2c(O)cc(cc2cc1S([O-])(=O)=O)S([O-])(=O)=O |w:9.10| Show InChI InChI=1S/C16H11ClN2O9S2/c17-8-1-2-11(20)10(5-8)18-19-15-13(30(26,27)28)4-7-3-9(29(23,24)25)6-12(21)14(7)16(15)22/h1-6,20-22H,(H,23,24,25)(H,26,27,28)/p-2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM50919 (2-methoxyethyl 4-amino-3-(2-methoxyethyl)-2-sulfan...) Show SMILES COCCOC(=O)c1sc(=S)n(CCOC)c1N Show InChI InChI=1S/C10H16N2O4S2/c1-14-4-3-12-8(11)7(18-10(12)17)9(13)16-6-5-15-2/h3-6,11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	8.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM40033 (MLS000087247 | N-(4-chlorobenzyl)-5-(2-thienyl)iso...) Show SMILES Clc1ccc(CNC(=O)c2cc(on2)-c2cccs2)cc1 Show InChI InChI=1S/C15H11ClN2O2S/c16-11-5-3-10(4-6-11)9-17-15(19)12-8-13(20-18-12)14-2-1-7-21-14/h1-8H,9H2,(H,17,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	8.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM50472 (4-[3-[(4-phenylbenzoyl)amino]phenoxy]phthalic acid...) Show SMILES OC(=O)c1ccc(Oc2cccc(NC(=O)c3ccc(cc3)-c3ccccc3)c2)cc1C(O)=O Show InChI InChI=1S/C27H19NO6/c29-25(19-11-9-18(10-12-19)17-5-2-1-3-6-17)28-20-7-4-8-21(15-20)34-22-13-14-23(26(30)31)24(16-22)27(32)33/h1-16H,(H,28,29)(H,30,31)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	8.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM53152 (1-methyl-4-(2-nitrophenyl)-4,6,7,8-tetrahydro-3H-q...) Show SMILES CN1C(=O)NC(C2=C1CCCC2=O)c1ccccc1[N+]([O-])=O |c:6| Show InChI InChI=1S/C15H15N3O4/c1-17-11-7-4-8-12(19)13(11)14(16-15(17)20)9-5-2-3-6-10(9)18(21)22/h2-3,5-6,14H,4,7-8H2,1H3,(H,16,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM55059 (6-hydroxy-9-phenyl-3-xanthenone | 6-hydroxy-9-phen...) Show SMILES Oc1ccc2c(-c3ccccc3)c3ccc(=O)cc3oc2c1 Show InChI InChI=1S/C19H12O3/c20-13-6-8-15-17(10-13)22-18-11-14(21)7-9-16(18)19(15)12-4-2-1-3-5-12/h1-11,20H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	1.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM51914 (2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(2-oxid...) Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1cc2ccccc2oc1=O |w:16.16| Show InChI InChI=1S/C28H26N4O4S/c1-3-32(4-2)13-14-35-27(33)19-9-11-22(12-10-19)30-17-21(16-29)26-31-24(18-37-26)23-15-20-7-5-6-8-25(20)36-28(23)34/h5-12,15,17-18,21H,3-4,13-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54943 (4-[[2-[(Z)-[1-[2-(2-methylanilino)-2-oxoethyl]-2,5...) Show SMILES Cc1ccccc1NC(=O)CN1C(=O)N\C(=C/c2ccccc2OCc2ccc(cc2)C(O)=O)C1=O Show InChI InChI=1S/C27H23N3O6/c1-17-6-2-4-8-21(17)28-24(31)15-30-25(32)22(29-27(30)35)14-20-7-3-5-9-23(20)36-16-18-10-12-19(13-11-18)26(33)34/h2-14H,15-16H2,1H3,(H,28,31)(H,29,35)(H,33,34)/b22-14-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM51882 (2-(diethylamino)ethyl 4-[[(Z)-2-cyano-2-[4-(3,4-di...) Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)N=CC(C#N)c1nc(cs1)-c1ccc(OC)c(OC)c1 |w:16.16| Show InChI InChI=1S/C27H30N4O4S/c1-5-31(6-2)13-14-35-27(32)19-7-10-22(11-8-19)29-17-21(16-28)26-30-23(18-36-26)20-9-12-24(33-3)25(15-20)34-4/h7-12,15,17-18,21H,5-6,13-14H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54926 (3-(4-nitrophenyl)-2H-phthalazine-1,4-dione | 3-(4-...) Show SMILES [O-][N+](=O)c1ccc(cc1)-n1[nH]c(=O)c2ccccc2c1=O Show InChI InChI=1S/C14H9N3O4/c18-13-11-3-1-2-4-12(11)14(19)16(15-13)9-5-7-10(8-6-9)17(20)21/h1-8H,(H,15,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54946 ((2S)-2-[[(2S)-1-oxo-2-[[1-oxo-3-(3,5,9-trimethyl-7...) Show SMILES C[C@H](NC(=O)CCc1c(C)c2cc3c(C)coc3c(C)c2oc1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C29H30N2O7/c1-15-14-37-25-17(3)26-22(13-21(15)25)16(2)20(29(36)38-26)10-11-24(32)30-18(4)27(33)31-23(28(34)35)12-19-8-6-5-7-9-19/h5-9,13-14,18,23H,10-12H2,1-4H3,(H,30,32)(H,31,33)(H,34,35)/t18-,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.68E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54930 ((4-{[(8-allyl-2-oxo-2H-chromen-3-yl)carbonyl]amino...) Show SMILES OC(=O)Cc1ccc(NC(=O)c2cc3cccc(CC=C)c3oc2=O)cc1 Show InChI InChI=1S/C21H17NO5/c1-2-4-14-5-3-6-15-12-17(21(26)27-19(14)15)20(25)22-16-9-7-13(8-10-16)11-18(23)24/h2-3,5-10,12H,1,4,11H2,(H,22,25)(H,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem	PCBioAssay	n/a	n/a	1.73E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54922 (4-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoi...) Show SMILES Oc1c2CC=CCc2c(O)n1-c1ccc(cc1)C(=O)Nc1ccc(Br)cc1 |c:4| Show InChI InChI=1S/C21H17BrN2O3/c22-14-7-9-15(10-8-14)23-19(25)13-5-11-16(12-6-13)24-20(26)17-3-1-2-4-18(17)21(24)27/h1-2,5-12,26-27H,3-4H2,(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.86E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM48706 ((E)-N-[[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoy...) Show SMILES CCc1nnc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccc(cc3)C(C)C)cc2)s1 |w:21.21| Show InChI InChI=1S/C23H25N5O3S3/c1-4-21-26-27-23(33-21)28-34(30,31)19-12-10-18(11-13-19)24-22(32)25-20(29)14-7-16-5-8-17(9-6-16)15(2)3/h5-15H,4H2,1-3H3,(H,27,28)(H2,24,25,29,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM60310 (5-(4-fluorophenyl)-3-phenyl-2-sulfanylidene-4H-[1,...) Show SMILES Fc1ccc(cc1)-c1nc2n(-c3ccccc3)c(=S)sc2c(=O)[nH]1 Show InChI InChI=1S/C17H10FN3OS2/c18-11-8-6-10(7-9-11)14-19-15-13(16(22)20-14)24-17(23)21(15)12-4-2-1-3-5-12/h1-9H,(H,19,20,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54934 (6-keto-N-(4-morpholinosulfonylphenyl)-1H-pyridine-...) Show SMILES O=C(Nc1ccc(cc1)S(=O)(=O)N1CCOCC1)c1ccc(=O)[nH]c1 Show InChI InChI=1S/C16H17N3O5S/c20-15-6-1-12(11-17-15)16(21)18-13-2-4-14(5-3-13)25(22,23)19-7-9-24-10-8-19/h1-6,11H,7-10H2,(H,17,20)(H,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM50508 (2-[5-[(Z)-(2-amino-3,7-dicyano-4,6-dimethyl-1-pyri...) Show SMILES Cc1c(C#N)c(N)[nH]c2c(C#N)c(=C)c(=Cc3ccc(o3)-c3ccccc3C(O)=O)c12 Show InChI InChI=1S/C24H16N4O3/c1-12-17(21-13(2)19(11-26)23(27)28-22(21)18(12)10-25)9-14-7-8-20(31-14)15-5-3-4-6-16(15)24(29)30/h3-9,28H,1,27H2,2H3,(H,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM32115 (4-[(4-methylbenzyl)amino]phenol | 4-[(4-methylphen...) Show SMILES Cc1ccc(CNc2ccc(O)cc2)cc1 Show InChI InChI=1S/C14H15NO/c1-11-2-4-12(5-3-11)10-15-13-6-8-14(16)9-7-13/h2-9,15-16H,10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	2.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM50864 (1-Butylamino-3-methyl-3H-naphtho[1,2,3-de]quinolin...) Show SMILES CCCCNc1c2-c3ccccc3C(=O)c3cccc(n(C)c1=O)c23 Show InChI InChI=1S/C21H20N2O2/c1-3-4-12-22-19-18-13-8-5-6-9-14(13)20(24)15-10-7-11-16(17(15)18)23(2)21(19)25/h5-11,22H,3-4,12H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM48875 ((4Z)-4-[(4-acetamidoanilino)methylene]-3-keto-N-ph...) Show SMILES CC(=O)Nc1ccc(cc1)N=Cc1c(O)c(cc2ccccc12)C(=O)Nc1ccccc1 |w:10.10| Show InChI InChI=1S/C26H21N3O3/c1-17(30)28-21-13-11-19(12-14-21)27-16-24-22-10-6-5-7-18(22)15-23(25(24)31)26(32)29-20-8-3-2-4-9-20/h2-16,31H,1H3,(H,28,30)(H,29,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.49E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54947 ((2S)-2-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylm...) Show SMILES Cc1c(OCC(=O)N[C@@H](Cc2ccccc2)C(O)=O)ccc2c(C)c(Cc3ccccc3)c(=O)oc12 Show InChI InChI=1S/C29H27NO6/c1-18-22-13-14-25(19(2)27(22)36-29(34)23(18)15-20-9-5-3-6-10-20)35-17-26(31)30-24(28(32)33)16-21-11-7-4-8-12-21/h3-14,24H,15-17H2,1-2H3,(H,30,31)(H,32,33)/t24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54928 (3-(4-tert-butylphenyl)-3-[2-(4-fluorophenyl)ethano...) Show SMILES CC(C)(C)c1ccc(cc1)C(CC(O)=O)NC(=O)Cc1ccc(F)cc1 Show InChI InChI=1S/C21H24FNO3/c1-21(2,3)16-8-6-15(7-9-16)18(13-20(25)26)23-19(24)12-14-4-10-17(22)11-5-14/h4-11,18H,12-13H2,1-3H3,(H,23,24)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.56E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM51255 (7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quin...) Show SMILES COC(=O)C1CN(C)C2Cc3c[nH]c4cccc(C2=C1)c34 |c:19| Show InChI InChI=1S/C17H18N2O2/c1-19-9-11(17(20)21-2)6-13-12-4-3-5-14-16(12)10(8-18-14)7-15(13)19/h3-6,8,11,15,18H,7,9H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54924 (4-[(4-benzoxybenzylidene)amino]phenol | 4-[(4-phen...) Show SMILES Oc1ccc(cc1)\N=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C20H17NO2/c22-19-10-8-18(9-11-19)21-14-16-6-12-20(13-7-16)23-15-17-4-2-1-3-5-17/h1-14,22H,15H2/b21-14+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM33093 (MLS000537607 | SMR000161417 | cid_990752 | dimethy...) Show SMILES COC(=O)c1c(C(=O)OC)c2cccc3cc(-c4ccccc4)c4ccc1c4n23 Show InChI InChI=1S/C24H17NO4/c1-28-23(26)20-17-12-11-16-18(14-7-4-3-5-8-14)13-15-9-6-10-19(25(15)22(16)17)21(20)24(27)29-2/h3-13H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.86E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54921 ((4Z)-4-[(4-hydroxyanilino)methylene]-2,2,5,5-tetra...) Show SMILES CC1(C)OC(C)(C)C(=CNc2ccc(O)cc2)C1=O |w:8.8| Show InChI InChI=1S/C15H19NO3/c1-14(2)12(13(18)15(3,4)19-14)9-16-10-5-7-11(17)8-6-10/h5-9,16-17H,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	4.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54935 (1-[(E)-4-Hydroxy-phenylimino]-4,4,6-trimethyl-1H,4...) Show SMILES CC1=CC(C)(C)N2C(=O)\C(=N\c3ccc(O)cc3)c3cccc1c23 |t:1| Show InChI InChI=1S/C20H18N2O2/c1-12-11-20(2,3)22-18-15(12)5-4-6-16(18)17(19(22)24)21-13-7-9-14(23)10-8-13/h4-11,23H,1-3H3/b21-17+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM33164 (4-[(2-ethoxybenzyl)amino]phenol | 4-[(2-ethoxyphen...) Show SMILES CCOc1ccccc1CNc1ccc(O)cc1 Show InChI InChI=1S/C15H17NO2/c1-2-18-15-6-4-3-5-12(15)11-16-13-7-9-14(17)10-8-13/h3-10,16-17H,2,11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54771 (3-amino-4-(ethylamino)benzoic acid | 3-azanyl-4-(e...) Show SMILES CCNc1ccc(cc1N)C(O)=O Show InChI InChI=1S/C9H12N2O2/c1-2-11-8-4-3-6(9(12)13)5-7(8)10/h3-5,11H,2,10H2,1H3,(H,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM50719 (2-furancarboxylic acid [3-[(E)-3-methoxyprop-1-eny...) Show SMILES COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)c3ccco3)C(=O)C2=CO1 |c:25,t:5,7| Show InChI InChI=1S/C19H16O7/c1-19(26-18(22)15-6-4-8-24-15)16(20)10-12-9-13(5-3-7-23-2)25-11-14(12)17(19)21/h3-6,8-11H,7H2,1-2H3/b5-3+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54911 (4-({3-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxybenzy...) Show SMILES COc1cc(CNc2ccc(O)cc2)cc(Br)c1OCc1ccccc1F Show InChI InChI=1S/C21H19BrFNO3/c1-26-20-11-14(12-24-16-6-8-17(25)9-7-16)10-18(22)21(20)27-13-15-4-2-3-5-19(15)23/h2-11,24-25H,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.27E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54917 (4-[(3-chloranyl-1-benzothiophen-2-yl)methylideneam...) Show SMILES Oc1ccc(cc1)\N=C\c1sc2ccccc2c1Cl Show InChI InChI=1S/C15H10ClNOS/c16-15-12-3-1-2-4-13(12)19-14(15)9-17-10-5-7-11(18)8-6-10/h1-9,18H/b17-9+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.28E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM32021 (4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen...) Show SMILES OC(=O)c1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1 Show InChI InChI=1S/C15H8O6/c16-9-3-1-2-7-11(9)14(19)12-8(13(7)18)4-6(15(20)21)5-10(12)17/h1-5,16-17H,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PCBioAssay	n/a	n/a	1.56E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54942 (3-(1,3-dioxo-2-isoindolyl)-N-(4-sulfamoylphenyl)be...) Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(c2)N2C(=O)c3ccccc3C2=O)cc1 Show InChI InChI=1S/C21H15N3O5S/c22-30(28,29)16-10-8-14(9-11-16)23-19(25)13-4-3-5-15(12-13)24-20(26)17-6-1-2-7-18(17)21(24)27/h1-12H,(H,23,25)(H2,22,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.71E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM60288 (3-(4-Methyl-benzoylamino)-9-aza-bicyclo[3.3.1]nona...) Show SMILES [H]C12CCCC([H])(CC(C1)NC(=O)c1ccc(C)cc1)N2C(=O)NC1CCCCC1 Show InChI InChI=1S/C23H33N3O2/c1-16-10-12-17(13-11-16)22(27)24-19-14-20-8-5-9-21(15-19)26(20)23(28)25-18-6-3-2-4-7-18/h10-13,18-21H,2-9,14-15H2,1H3,(H,24,27)(H,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM50080733 (4-(4-aminophenylsulfonamido)-1-benzenesulfonamide ...) Show SMILES Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C12H13N3O4S2/c13-9-1-5-12(6-2-9)21(18,19)15-10-3-7-11(8-4-10)20(14,16)17/h1-8,15H,13H2,(H2,14,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54901 (3-[3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-methoxyet...) Show SMILES COCCn1nnnc1C(N1CCc2ccccc2C1)c1cc2ccc(OC)cc2[nH]c1=O Show InChI InChI=1S/C24H26N6O3/c1-32-12-11-30-23(26-27-28-30)22(29-10-9-16-5-3-4-6-18(16)15-29)20-13-17-7-8-19(33-2)14-21(17)25-24(20)31/h3-8,13-14,22H,9-12,15H2,1-2H3,(H,25,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM60289 (3-(4-Benzyl-piperazin-1-yl)-N-(3-chloro-phenyl)-pr...) Show SMILES Clc1cccc(NC(=O)CCN2CCN(Cc3ccccc3)CC2)c1 Show InChI InChI=1S/C20H24ClN3O/c21-18-7-4-8-19(15-18)22-20(25)9-10-23-11-13-24(14-12-23)16-17-5-2-1-3-6-17/h1-8,15H,9-14,16H2,(H,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54902 (1-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)-3-(...) Show SMILES CC(NC(=O)Nc1ccc(O)cc1)(C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C11H10F6N2O2/c1-9(10(12,13)14,11(15,16)17)19-8(21)18-6-2-4-7(20)5-3-6/h2-5,20H,1H3,(H2,18,19,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM60290 (2-(dimethylamino)ethyl 3-phenylpropanoate;hydrochl...) Show SMILES CN(C)CCOC(=O)CCc1ccccc1 Show InChI InChI=1S/C13H19NO2/c1-14(2)10-11-16-13(15)9-8-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54903 (2-hydroximino-N-[2-(1-methylpiperidin-1-ium-1-yl)e...) Show SMILES C[N+]1(CCNC(=O)CN=O)CCCCC1 Show InChI InChI=1S/C10H19N3O2/c1-13(6-3-2-4-7-13)8-5-11-10(14)9-12-15/h2-9H2,1H3/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54904 (MLS000053162 | N-(1,3-benzodioxol-5-ylmethyl)-2-(3...) Show SMILES COc1cc(CC(=O)NCc2ccc3OCOc3c2)cc(OC)c1OC Show InChI InChI=1S/C19H21NO6/c1-22-16-7-13(8-17(23-2)19(16)24-3)9-18(21)20-10-12-4-5-14-15(6-12)26-11-25-14/h4-8H,9-11H2,1-3H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM37707 ((2Z)-2-amino-3-({(1E)-[4-(diethylamino)phenyl]meth...) Show SMILES CCN(CC)c1ccc(C=NC(C#N)C(=N)C#N)cc1 |w:10.10| Show InChI InChI=1S/C15H17N5/c1-3-20(4-2)13-7-5-12(6-8-13)11-19-15(10-17)14(18)9-16/h5-8,11,15,18H,3-4H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM60291 (4-[5-(3,4-dimethoxyphenyl)-1,2,3-triazol-1-yl]anil...) Show SMILES COc1ccc(cc1OC)-c1cnnn1-c1ccc(N)cc1 Show InChI InChI=1S/C16H16N4O2/c1-21-15-8-3-11(9-16(15)22-2)14-10-18-19-20(14)13-6-4-12(17)5-7-13/h3-10H,17H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM39880 (1-(ethylamino)-3-methyl-3H-naphtho[1,2,3-de]quinol...) Show SMILES CCNc1c2-c3ccccc3C(=O)c3cccc(n(C)c1=O)c23 Show InChI InChI=1S/C19H16N2O2/c1-3-20-17-16-11-7-4-5-8-12(11)18(22)13-9-6-10-14(15(13)16)21(2)19(17)23/h4-10,20H,3H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM60292 (3-(2,3-dihydro-1H-indol-1-ylcarbonyl)-8-methoxy-2H...) Show SMILES COc1cccc2cc(C(=O)N3CCc4ccccc34)c(=O)oc12 Show InChI InChI=1S/C19H15NO4/c1-23-16-8-4-6-13-11-14(19(22)24-17(13)16)18(21)20-10-9-12-5-2-3-7-15(12)20/h2-8,11H,9-10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair
Plectin (Homo sapiens (Human))	BDBM54905 (MLS000052794 | N-(1,3-benzodioxol-5-yl)-5,7-dimeth...) Show SMILES Cc1cc(C)n2ncc(C(=O)Nc3ccc4OCOc4c3)c2n1 Show InChI InChI=1S/C16H14N4O3/c1-9-5-10(2)20-15(18-9)12(7-17-20)16(21)19-11-3-4-13-14(6-11)23-8-22-13/h3-7H,8H2,1-2H3,(H,19,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2QZ28D7
					More data for this Ligand-Target Pair

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