Compile Data Set for Download or QSAR

Found 43 hits Enz. Inhib. hit(s) with all data for entry = 50015324   

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
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154473 (6-Bromo-3-(4-bromo-benzyl)-1-(3,5-dichloro-phenyl)...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nc(Br)cn12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C19H13Br2Cl2N3O/c1-19(9-11-2-4-12(20)5-3-11)17(27)26(18-24-16(21)10-25(18)19)15-7-13(22)6-14(23)8-15/h2-8,10H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	630	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154504 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCCC(O)C1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H23BrCl2N4O4S/c1-24(12-15-4-6-16(25)7-5-15)22(33)30(19-10-17(26)9-18(27)11-19)23-28-13-21(31(23)24)36(34,35)29-8-2-3-20(32)14-29/h4-7,9-11,13,20,32H,2-3,8,12,14H2,1H3/t20?,24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154475 (3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-metha...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(C)(=O)=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H16BrCl2N3O3S/c1-20(10-12-3-5-13(21)6-4-12)18(27)25(16-8-14(22)7-15(23)9-16)19-24-11-17(26(19)20)30(2,28)29/h3-9,11H,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154472 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCC(=O)CC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H21BrCl2N4O4S/c1-24(13-15-2-4-16(25)5-3-15)22(33)30(19-11-17(26)10-18(27)12-19)23-28-14-21(31(23)24)36(34,35)29-8-6-20(32)7-9-29/h2-5,10-12,14H,6-9,13H2,1H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154478 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES COCCCS(=O)(=O)c1cnc2N(C(=O)[C@@](C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C23H22BrCl2N3O4S/c1-23(13-15-4-6-16(24)7-5-15)21(30)28(19-11-17(25)10-18(26)12-19)22-27-14-20(29(22)23)34(31,32)9-3-8-33-2/h4-7,10-12,14H,3,8-9,13H2,1-2H3/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154479 ((R)-5-(3-Amino-propane-1-sulfonyl)-3-(4-bromo-benz...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)CCCN)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C22H21BrCl2N4O3S/c1-22(12-14-3-5-15(23)6-4-14)20(30)28(18-10-16(24)9-17(25)11-18)21-27-13-19(29(21)22)33(31,32)8-2-7-26/h3-6,9-11,13H,2,7-8,12,26H2,1H3/t22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154480 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCOCC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C23H21BrCl2N4O4S/c1-23(13-15-2-4-16(24)5-3-15)21(31)29(19-11-17(25)10-18(26)12-19)22-27-14-20(30(22)23)35(32,33)28-6-8-34-9-7-28/h2-5,10-12,14H,6-9,13H2,1H3/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154481 (Acetic acid 3-[(R)-5-(4-bromo-benzyl)-7-(3,5-dichl...) Show SMILES CC(=O)OCCCS(=O)(=O)c1cnc2N(C(=O)[C@@](C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H22BrCl2N3O5S/c1-15(31)35-8-3-9-36(33,34)21-14-28-23-29(20-11-18(26)10-19(27)12-20)22(32)24(2,30(21)23)13-16-4-6-17(25)7-5-16/h4-7,10-12,14H,3,8-9,13H2,1-2H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154482 (5-(4-Bromo-benzyl)-7-(3,5-dichloro-phenyl)-5-methy...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(C#N)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H13BrCl2N4O/c1-20(9-12-2-4-13(21)5-3-12)18(28)26(16-7-14(22)6-15(23)8-16)19-25-11-17(10-24)27(19)20/h2-8,11H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154483 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCC(O)CC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H23BrCl2N4O4S/c1-24(13-15-2-4-16(25)5-3-15)22(33)30(19-11-17(26)10-18(27)12-19)23-28-14-21(31(23)24)36(34,35)29-8-6-20(32)7-9-29/h2-5,10-12,14,20,32H,6-9,13H2,1H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154485 (3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-metho...) Show SMILES COc1cnc2N(C(=O)C(C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H16BrCl2N3O2/c1-20(10-12-3-5-13(21)6-4-12)18(27)25(16-8-14(22)7-15(23)9-16)19-24-11-17(28-2)26(19)20/h3-9,11H,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154484 (3-Benzyl-1-(3,5-dichloro-phenyl)-3-methyl-1,3-dihy...) Show SMILES CC1(Cc2ccccc2)C(=O)N(c2ccccc12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C22H17Cl2NO/c1-22(14-15-7-3-2-4-8-15)19-9-5-6-10-20(19)25(21(22)26)18-12-16(23)11-17(24)13-18/h2-13H,14H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154486 (6-(4-Bromo-benzyl)-4-(3,5-dichloro-phenyl)-6-methy...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nnnn12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C17H12BrCl2N5O/c1-17(9-10-2-4-11(18)5-3-10)15(26)24(16-21-22-23-25(16)17)14-7-12(19)6-13(20)8-14/h2-8H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154481 (Acetic acid 3-[(R)-5-(4-bromo-benzyl)-7-(3,5-dichl...) Show SMILES CC(=O)OCCCS(=O)(=O)c1cnc2N(C(=O)[C@@](C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H22BrCl2N3O5S/c1-15(31)35-8-3-9-36(33,34)21-14-28-23-29(20-11-18(26)10-19(27)12-20)22(32)24(2,30(21)23)13-16-4-6-17(25)7-5-16/h4-7,10-12,14H,3,8-9,13H2,1-2H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant against human Lymphocyte function associated antigen1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154487 (3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-6-metha...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nc(cn12)S(C)(=O)=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H16BrCl2N3O3S/c1-20(10-12-3-5-13(21)6-4-12)18(27)26(16-8-14(22)7-15(23)9-16)19-24-17(11-25(19)20)30(2,28)29/h3-9,11H,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	920	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154488 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCNCC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C23H22BrCl2N5O3S/c1-23(13-15-2-4-16(24)5-3-15)21(32)30(19-11-17(25)10-18(26)12-19)22-28-14-20(31(22)23)35(33,34)29-8-6-27-7-9-29/h2-5,10-12,14,27H,6-9,13H2,1H3/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154489 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2nccn12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C19H14BrCl2N3O/c1-19(11-12-2-4-13(20)5-3-12)17(26)25(18-23-6-7-24(18)19)16-9-14(21)8-15(22)10-16/h2-10H,11H2,1H3/t19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154476 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)CCCO)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C22H20BrCl2N3O4S/c1-22(12-14-3-5-15(23)6-4-14)20(30)27(18-10-16(24)9-17(25)11-18)21-26-13-19(28(21)22)33(31,32)8-2-7-29/h3-6,9-11,13,29H,2,7-8,12H2,1H3/t22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154483 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCC(O)CC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H23BrCl2N4O4S/c1-24(13-15-2-4-16(25)5-3-15)22(33)30(19-11-17(26)10-18(27)12-19)23-28-14-21(31(23)24)36(34,35)29-8-6-20(32)7-9-29/h2-5,10-12,14,20,32H,6-9,13H2,1H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant against human Lymphocyte function associated antigen1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154483 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCC(O)CC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H23BrCl2N4O4S/c1-24(13-15-2-4-16(25)5-3-15)22(33)30(19-11-17(26)10-18(27)12-19)23-28-14-21(31(23)24)36(34,35)29-8-6-20(32)7-9-29/h2-5,10-12,14,20,32H,6-9,13H2,1H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function-associated antigen-1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154490 (3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-methy...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nccn12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C19H14BrCl2N3O/c1-19(11-12-2-4-13(20)5-3-12)17(26)25(18-23-6-7-24(18)19)16-9-14(21)8-15(22)10-16/h2-10H,11H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154493 (6-Acetyl-3-(4-bromo-benzyl)-1-(3,5-dichloro-phenyl...) Show SMILES CC(=O)c1cn2c(n1)N(C(=O)C2(C)Cc1ccc(Br)cc1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C21H16BrCl2N3O2/c1-12(28)18-11-26-20(25-18)27(17-8-15(23)7-16(24)9-17)19(29)21(26,2)10-13-3-5-14(22)6-4-13/h3-9,11H,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.62E+3	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154491 (5-Acetyl-3-(4-bromo-benzyl)-1-(3,5-dichloro-phenyl...) Show SMILES CC(=O)c1cnc2N(C(=O)C(C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C21H16BrCl2N3O2/c1-12(28)18-11-25-20-26(17-8-15(23)7-16(24)9-17)19(29)21(2,27(18)20)10-13-3-5-14(22)6-4-13/h3-9,11H,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154492 (CHEMBL188615 | N-{3-[(R)-5-(4-Bromo-benzyl)-7-(3,5...) Show SMILES CC(=O)NCCCS(=O)(=O)c1cnc2N(C(=O)[C@@](C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H23BrCl2N4O4S/c1-15(32)28-8-3-9-36(34,35)21-14-29-23-30(20-11-18(26)10-19(27)12-20)22(33)24(2,31(21)23)13-16-4-6-17(25)7-5-16/h4-7,10-12,14H,3,8-9,13H2,1-2H3,(H,28,32)/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154472 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCC(=O)CC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H21BrCl2N4O4S/c1-24(13-15-2-4-16(25)5-3-15)22(33)30(19-11-17(26)10-18(27)12-19)23-28-14-21(31(23)24)36(34,35)29-8-6-20(32)7-9-29/h2-5,10-12,14H,6-9,13H2,1H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant against human Lymphocyte function associated antigen1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154495 ((S)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@]1(Cc2ccc(Br)cc2)C(=O)N(c2nccn12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C19H14BrCl2N3O/c1-19(11-12-2-4-13(20)5-3-12)17(26)25(18-23-6-7-24(18)19)16-9-14(21)8-15(22)10-16/h2-10H,11H2,1H3/t19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	>7.00E+3	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154494 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)CCO)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C21H18BrCl2N3O4S/c1-21(11-13-2-4-14(22)5-3-13)19(29)26(17-9-15(23)8-16(24)10-17)20-25-12-18(27(20)21)32(30,31)7-6-28/h2-5,8-10,12,28H,6-7,11H2,1H3/t21-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154492 (CHEMBL188615 | N-{3-[(R)-5-(4-Bromo-benzyl)-7-(3,5...) Show SMILES CC(=O)NCCCS(=O)(=O)c1cnc2N(C(=O)[C@@](C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H23BrCl2N4O4S/c1-15(32)28-8-3-9-36(34,35)21-14-29-23-30(20-11-18(26)10-19(27)12-20)22(33)24(2,31(21)23)13-16-4-6-17(25)7-5-16/h4-7,10-12,14H,3,8-9,13H2,1-2H3,(H,28,32)/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant against human Lymphocyte function associated antigen1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154497 (5-(4-Bromo-benzyl)-7-(3,5-dichloro-phenyl)-5-methy...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nc(cn12)C#N)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H13BrCl2N4O/c1-20(9-12-2-4-13(21)5-3-12)18(28)27(17-7-14(22)6-15(23)8-17)19-25-16(10-24)11-26(19)20/h2-8,11H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154488 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCNCC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C23H22BrCl2N5O3S/c1-23(13-15-2-4-16(24)5-3-15)21(32)30(19-11-17(25)10-18(26)12-19)22-28-14-20(31(22)23)35(33,34)29-8-6-27-7-9-29/h2-5,10-12,14,27H,6-9,13H2,1H3/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant against human Lymphocyte function associated antigen1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154476 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)CCCO)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C22H20BrCl2N3O4S/c1-22(12-14-3-5-15(23)6-4-14)20(30)27(18-10-16(24)9-17(25)11-18)21-26-13-19(28(21)22)33(31,32)8-2-7-29/h3-6,9-11,13,29H,2,7-8,12H2,1H3/t22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant against human Lymphocyte function associated antigen1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154502 (Acetic acid 4-[(R)-5-(4-bromo-benzyl)-7-(3,5-dichl...) Show SMILES CC(=O)OCCCCS(=O)(=O)c1cnc2N(C(=O)[C@@](C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C25H24BrCl2N3O5S/c1-16(32)36-9-3-4-10-37(34,35)22-15-29-24-30(21-12-19(27)11-20(28)13-21)23(33)25(2,31(22)24)14-17-5-7-18(26)8-6-17/h5-8,11-13,15H,3-4,9-10,14H2,1-2H3/t25-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154498 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)N1CCCCC1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C24H23BrCl2N4O3S/c1-24(14-16-5-7-17(25)8-6-16)22(32)30(20-12-18(26)11-19(27)13-20)23-28-15-21(31(23)24)35(33,34)29-9-3-2-4-10-29/h5-8,11-13,15H,2-4,9-10,14H2,1H3/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154505 (5-Bromo-3-(4-bromo-benzyl)-1-(3,5-dichloro-phenyl)...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(Br)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C19H13Br2Cl2N3O/c1-19(9-11-2-4-12(20)5-3-11)17(27)25(18-24-10-16(21)26(18)19)15-7-13(22)6-14(23)8-15/h2-8,10H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154496 ((R)-5-(4-Bromo-benzyl)-3-(3,5-dichloro-phenyl)-1,5...) Show SMILES CN1C(=O)N(C(=O)[C@@]1(C)Cc1ccc(Br)cc1)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C18H15BrCl2N2O2/c1-18(10-11-3-5-12(19)6-4-11)16(24)23(17(25)22(18)2)15-8-13(20)7-14(21)9-15/h3-9H,10H2,1-2H3/t18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154499 (3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3,5-dim...) Show SMILES Cc1cnc2N(C(=O)C(C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H16BrCl2N3O/c1-12-11-24-19-25(17-8-15(22)7-16(23)9-17)18(27)20(2,26(12)19)10-13-3-5-14(21)6-4-13/h3-9,11H,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154501 (5-(4-Bromo-benzyl)-7-(3,5-dichloro-phenyl)-5-methy...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nncn12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C18H13BrCl2N4O/c1-18(9-11-2-4-12(19)5-3-11)16(26)25(17-23-22-10-24(17)18)15-7-13(20)6-14(21)8-15/h2-8,10H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154476 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)CCCO)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C22H20BrCl2N3O4S/c1-22(12-14-3-5-15(23)6-4-14)20(30)27(18-10-16(24)9-17(25)11-18)21-26-13-19(28(21)22)33(31,32)8-2-7-29/h3-6,9-11,13,29H,2,7-8,12H2,1H3/t22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154506 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-(...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(=O)(=O)CCCCO)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C23H22BrCl2N3O4S/c1-23(13-15-4-6-16(24)7-5-15)21(31)28(19-11-17(25)10-18(26)12-19)22-27-14-20(29(22)23)34(32,33)9-3-2-8-30/h4-7,10-12,14,30H,2-3,8-9,13H2,1H3/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154500 (3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-6-iodo-...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nc(I)cn12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C19H13BrCl2IN3O/c1-19(9-11-2-4-12(20)5-3-11)17(27)26(18-24-16(23)10-25(18)19)15-7-13(21)6-14(22)8-15/h2-8,10H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154477 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-m...) Show SMILES C[C@@]1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(n12)S(C)(=O)=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H16BrCl2N3O3S/c1-20(10-12-3-5-13(21)6-4-12)18(27)25(16-8-14(22)7-15(23)9-16)19-24-11-17(26(19)20)30(2,28)29/h3-9,11H,10H2,1-2H3/t20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154503 ((R)-3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-3-m...) Show SMILES CNCCCS(=O)(=O)c1cnc2N(C(=O)[C@@](C)(Cc3ccc(Br)cc3)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C23H23BrCl2N4O3S/c1-23(13-15-4-6-16(24)7-5-15)21(31)29(19-11-17(25)10-18(26)12-19)22-28-14-20(30(22)23)34(32,33)9-3-8-27-2/h4-7,10-12,14,27H,3,8-9,13H2,1-2H3/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair
Integrin alpha-L/beta-2 (Homo sapiens (Human))	BDBM50154474 (3-(4-Bromo-benzyl)-1-(3,5-dichloro-phenyl)-5-iodo-...) Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2ncc(I)n12)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C19H13BrCl2IN3O/c1-19(9-11-2-4-12(20)5-3-11)17(27)25(18-24-10-16(23)26(18)19)15-7-13(21)6-14(22)8-15/h2-8,10H,9H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay				J Med Chem 47: 5356-66 (2004) Article DOI: 10.1021/jm049657b BindingDB Entry DOI: 10.7270/Q2B857MB
					More data for this Ligand-Target Pair