Compile Data Set for Download or QSAR

Found 157 hits Enz. Inhib. hit(s) with all data for entry = 11224   

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-V/beta-6 (Homo sapiens (Human))	BDBM448845 (US10696672, Compound 77 | US11634418, Compound 77) Show SMILES CC(C)(O)CN1CCC[C@H]1C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C27H43N5O4/c1-27(2,36)18-32-14-4-6-23(32)25(33)30-22(26(34)35)12-16-31-15-11-19(17-31)7-9-21-10-8-20-5-3-13-28-24(20)29-21/h8,10,19,22-23,36H,3-7,9,11-18H2,1-2H3,(H,28,29)(H,30,33)(H,34,35)/t19-,22+,23+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448846 (US10696672, Compound 78 | US11634418, Compound 78) Show SMILES CCCCC(=O)N1CCC[C@H](C1)C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C29H45N5O4/c1-2-3-8-26(35)34-16-5-7-23(20-34)28(36)32-25(29(37)38)14-18-33-17-13-21(19-33)9-11-24-12-10-22-6-4-15-30-27(22)31-24/h10,12,21,23,25H,2-9,11,13-20H2,1H3,(H,30,31)(H,32,36)(H,37,38)/t21-,23-,25+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448847 (US10696672, Compound 79 | US11634418, Compound 79) Show SMILES CC(C)(C)C(=O)N1CCC[C@H](C1)C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C29H45N5O4/c1-29(2,3)28(38)34-15-5-7-22(19-34)26(35)32-24(27(36)37)13-17-33-16-12-20(18-33)8-10-23-11-9-21-6-4-14-30-25(21)31-23/h9,11,20,22,24H,4-8,10,12-19H2,1-3H3,(H,30,31)(H,32,35)(H,36,37)/t20-,22-,24+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448848 (US10696672, Compound 80 | US11634418, Compound 80) Show SMILES COC(=O)N1CCC[C@H](C1)C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C26H39N5O5/c1-36-26(35)31-13-3-5-20(17-31)24(32)29-22(25(33)34)11-15-30-14-10-18(16-30)6-8-21-9-7-19-4-2-12-27-23(19)28-21/h7,9,18,20,22H,2-6,8,10-17H2,1H3,(H,27,28)(H,29,32)(H,33,34)/t18-,20-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448850 (US10696672, Compound 82 | US11634418, Compound 82) Show SMILES Cn1nc(-c2ccccc2)c2cccc(C(=O)N[C@@H](CCN3CC[C@@H](CCc4ccc5CCCNc5n4)C3)C(O)=O)c12 |r| Show InChI InChI=1S/C33H38N6O3/c1-38-30-26(29(37-38)23-7-3-2-4-8-23)10-5-11-27(30)32(40)36-28(33(41)42)17-20-39-19-16-22(21-39)12-14-25-15-13-24-9-6-18-34-31(24)35-25/h2-5,7-8,10-11,13,15,22,28H,6,9,12,14,16-21H2,1H3,(H,34,35)(H,36,40)(H,41,42)/t22-,28+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448851 (US10696672, Compound 83 | US11634418, Compound 83) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(c1)-c1ccccc1 |r| Show InChI InChI=1S/C31H36N4O3/c36-30(26-9-4-8-25(20-26)23-6-2-1-3-7-23)34-28(31(37)38)16-19-35-18-15-22(21-35)11-13-27-14-12-24-10-5-17-32-29(24)33-27/h1-4,6-9,12,14,20,22,28H,5,10-11,13,15-19,21H2,(H,32,33)(H,34,36)(H,37,38)/t22-,28-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448852 (US10696672, Compound 84 | US11634418, Compound 84) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(c1)-c1cncs1 |r| Show InChI InChI=1S/C28H33N5O3S/c34-27(22-4-1-3-21(15-22)25-16-29-18-37-25)32-24(28(35)36)11-14-33-13-10-19(17-33)6-8-23-9-7-20-5-2-12-30-26(20)31-23/h1,3-4,7,9,15-16,18-19,24H,2,5-6,8,10-14,17H2,(H,30,31)(H,32,34)(H,35,36)/t19-,24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448853 (US10696672, Compound 85 | US11634418, Compound 85) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(c1)-c1cscn1 |r| Show InChI InChI=1S/C28H33N5O3S/c34-27(22-4-1-3-21(15-22)25-17-37-18-30-25)32-24(28(35)36)11-14-33-13-10-19(16-33)6-8-23-9-7-20-5-2-12-29-26(20)31-23/h1,3-4,7,9,15,17-19,24H,2,5-6,8,10-14,16H2,(H,29,31)(H,32,34)(H,35,36)/t19-,24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448854 (US10696672, Compound 86 | US11634418, Compound 86) Show SMILES Cn1nccc1-c1cccc(c1)C(=O)N[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C29H36N6O3/c1-34-26(11-15-31-34)22-4-2-5-23(18-22)28(36)33-25(29(37)38)13-17-35-16-12-20(19-35)7-9-24-10-8-21-6-3-14-30-27(21)32-24/h2,4-5,8,10-11,15,18,20,25H,3,6-7,9,12-14,16-17,19H2,1H3,(H,30,32)(H,33,36)(H,37,38)/t20-,25-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448855 (US10696672, Compound 87 | US11634418, Compound 87) Show SMILES Cn1cc(cn1)-c1cccc(c1)C(=O)N[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C29H36N6O3/c1-34-19-24(17-31-34)22-4-2-5-23(16-22)28(36)33-26(29(37)38)12-15-35-14-11-20(18-35)7-9-25-10-8-21-6-3-13-30-27(21)32-25/h2,4-5,8,10,16-17,19-20,26H,3,6-7,9,11-15,18H2,1H3,(H,30,32)(H,33,36)(H,37,38)/t20-,26-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448856 (US10696672, Compound 88 | US11634418, Compound 88) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(c1)-c1ncco1 |r| Show InChI InChI=1S/C28H33N5O4/c34-26(21-3-1-4-22(17-21)27-30-13-16-37-27)32-24(28(35)36)11-15-33-14-10-19(18-33)6-8-23-9-7-20-5-2-12-29-25(20)31-23/h1,3-4,7,9,13,16-17,19,24H,2,5-6,8,10-12,14-15,18H2,(H,29,31)(H,32,34)(H,35,36)/t19-,24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448857 (US10696672, Compound 89 | US11634418, Compound 89) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)[C@@H]1COCCN1Cc1ccccc1 |r| Show InChI InChI=1S/C30H41N5O4/c36-29(27-21-39-18-17-35(27)20-22-5-2-1-3-6-22)33-26(30(37)38)13-16-34-15-12-23(19-34)8-10-25-11-9-24-7-4-14-31-28(24)32-25/h1-3,5-6,9,11,23,26-27H,4,7-8,10,12-21H2,(H,31,32)(H,33,36)(H,37,38)/t23-,26+,27+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448858 (US10696672, Compound 90 | US11634418, Compound 90) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)[C@@H]1CCCN1Cc1ncccn1 |r| Show InChI InChI=1S/C28H39N7O3/c36-27(24-5-2-15-35(24)19-25-29-13-3-14-30-25)33-23(28(37)38)11-17-34-16-10-20(18-34)6-8-22-9-7-21-4-1-12-31-26(21)32-22/h3,7,9,13-14,20,23-24H,1-2,4-6,8,10-12,15-19H2,(H,31,32)(H,33,36)(H,37,38)/t20-,23+,24+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448860 (US10696672, Compound 92 | US11634418, Compound 92) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)[C@@H]1CCCN1CC1CCC1 |r| Show InChI InChI=1S/C28H43N5O3/c34-27(25-7-3-15-33(25)19-20-4-1-5-20)31-24(28(35)36)13-17-32-16-12-21(18-32)8-10-23-11-9-22-6-2-14-29-26(22)30-23/h9,11,20-21,24-25H,1-8,10,12-19H2,(H,29,30)(H,31,34)(H,35,36)/t21-,24+,25+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448863 (US10696672, Compound 95 | US11634418, Compound 95) Show SMILES CCC(CC)C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C24H38N4O3/c1-3-18(4-2)23(29)27-21(24(30)31)12-15-28-14-11-17(16-28)7-9-20-10-8-19-6-5-13-25-22(19)26-20/h8,10,17-18,21H,3-7,9,11-16H2,1-2H3,(H,25,26)(H,27,29)(H,30,31)/t17-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448867 (US10696672, Compound 99 | US11634418, Compound 99) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)[C@@H]1CCCN1Cc1cccnc1 |r| Show InChI InChI=1S/C29H40N6O3/c36-28(26-6-3-15-35(26)20-22-4-1-13-30-18-22)33-25(29(37)38)12-17-34-16-11-21(19-34)7-9-24-10-8-23-5-2-14-31-27(23)32-24/h1,4,8,10,13,18,21,25-26H,2-3,5-7,9,11-12,14-17,19-20H2,(H,31,32)(H,33,36)(H,37,38)/t21-,25+,26+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448871 (US10696672, Compound 103 | US11634418, Compound 10...) Show SMILES OC(=O)[C@H](CCN1CCC[C@](F)(CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(F)c1Cl |r| Show InChI InChI=1S/C26H31ClF2N4O3/c27-22-19(5-1-6-20(22)28)24(34)32-21(25(35)36)10-15-33-14-3-11-26(29,16-33)12-9-18-8-7-17-4-2-13-30-23(17)31-18/h1,5-8,21H,2-4,9-16H2,(H,30,31)(H,32,34)(H,35,36)/t21-,26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448872 (US10696672, Compound 104 | US11634418, Compound 10...) Show SMILES OC(=O)[C@H](CCN1CCC[C@](F)(CCc2ccc3CCCNc3n2)C1)NC(=O)c1cc(F)cc(F)c1 |r| Show InChI InChI=1S/C26H31F3N4O3/c27-19-13-18(14-20(28)15-19)24(34)32-22(25(35)36)7-12-33-11-2-8-26(29,16-33)9-6-21-5-4-17-3-1-10-30-23(17)31-21/h4-5,13-15,22H,1-3,6-12,16H2,(H,30,31)(H,32,34)(H,35,36)/t22-,26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448874 (US10696672, Compound 106 | US11634418, Compound 10...) Show SMILES Cn1ncc2ccc(cc12)C(=O)N[C@@H](CCN1CCC[C@@](F)(CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C28H35FN6O3/c1-34-24-16-20(5-6-21(24)17-31-34)26(36)33-23(27(37)38)10-15-35-14-3-11-28(29,18-35)12-9-22-8-7-19-4-2-13-30-25(19)32-22/h5-8,16-17,23H,2-4,9-15,18H2,1H3,(H,30,32)(H,33,36)(H,37,38)/t23-,28+/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448875 (US10696672, Compound 107 | US11634418, Compound 10...) Show SMILES OC(=O)[C@H](CCN1CCC[C@@](F)(CCc2ccc3CCCNc3n2)C1)NC(=O)C1CCC(F)(F)CC1 |r| Show InChI InChI=1S/C26H37F3N4O3/c27-25(11-8-20-5-4-18-3-1-14-30-22(18)31-20)10-2-15-33(17-25)16-9-21(24(35)36)32-23(34)19-6-12-26(28,29)13-7-19/h4-5,19,21H,1-3,6-17H2,(H,30,31)(H,32,34)(H,35,36)/t21-,25+/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448878 (US10696672, Compound 110 | US11634418, Compound 11...) Show SMILES Cn1ncc2ccc(cc12)C(=O)N[C@@H](CCN1CCC[C@](F)(CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C28H35FN6O3/c1-34-24-16-20(5-6-21(24)17-31-34)26(36)33-23(27(37)38)10-15-35-14-3-11-28(29,18-35)12-9-22-8-7-19-4-2-13-30-25(19)32-22/h5-8,16-17,23H,2-4,9-15,18H2,1H3,(H,30,32)(H,33,36)(H,37,38)/t23-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448883 (US10696672, Compound 115 | US11634418, Compound 11...) Show SMILES OC(=O)[C@H](CCN1CC(C1)OCCc1ccc2CCCNc2n1)NC(=O)c1c(Cl)cccc1Cl |r| Show InChI InChI=1S/C24H28Cl2N4O4/c25-18-4-1-5-19(26)21(18)23(31)29-20(24(32)33)8-11-30-13-17(14-30)34-12-9-16-7-6-15-3-2-10-27-22(15)28-16/h1,4-7,17,20H,2-3,8-14H2,(H,27,28)(H,29,31)(H,32,33)/t20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448891 (US10696672, Compound 123 | US11634418, Compound 12...) Show SMILES OC(=O)[C@H](CCN1CC(C1)OCCc1ccc2CCCNc2n1)NC(=O)[C@@H]1CCCN1Cc1ccccc1 |r| Show InChI InChI=1S/C29H39N5O4/c35-28(26-9-5-15-34(26)18-21-6-2-1-3-7-21)32-25(29(36)37)12-16-33-19-24(20-33)38-17-13-23-11-10-22-8-4-14-30-27(22)31-23/h1-3,6-7,10-11,24-26H,4-5,8-9,12-20H2,(H,30,31)(H,32,35)(H,36,37)/t25-,26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448895 (US10696672, Compound 127 | US11634418, Compound 12...) Show SMILES OC(=O)[C@H](CCN1CC(C1)OCCc1ccc2CCCNc2n1)NC(=O)[C@@H]1CCCN1c1ccccc1 |r| Show InChI InChI=1S/C28H37N5O4/c34-27(25-9-5-15-33(25)22-7-2-1-3-8-22)31-24(28(35)36)12-16-32-18-23(19-32)37-17-13-21-11-10-20-6-4-14-29-26(20)30-21/h1-3,7-8,10-11,23-25H,4-6,9,12-19H2,(H,29,30)(H,31,34)(H,35,36)/t24-,25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM601587 (US11634418, Compound 141) Show SMILES NCCCc1ccc(CCC2CC3CCC2N3CC[C@H](NC(=O)c2cc(F)cc(c2)C(F)(F)F)C(O)=O)nc1 |r,TLB:9:10:13.14:16| Show InChI	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448914 (US10696672, Compound 146 | US11634418, Compound 14...) Show SMILES OC(=O)[C@H](CCN1CC[C@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1c(Cl)cccc1Cl |r| Show InChI InChI=1S/C25H30Cl2N4O3/c26-19-4-1-5-20(27)22(19)24(32)30-21(25(33)34)11-14-31-13-10-16(15-31)6-8-18-9-7-17-3-2-12-28-23(17)29-18/h1,4-5,7,9,16,21H,2-3,6,8,10-15H2,(H,28,29)(H,30,32)(H,33,34)/t16-,21-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM601385 ((R)-2-pivalamido-4-((R)-3-(2-(5,6,7,8- | US1163441...) Show SMILES CC(C)(C)C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448743 ((S)-2-((tert-butoxycarbonyl)amino)-4- | US10696672...) Show SMILES CC(C)(C)OC(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C23H36N4O4/c1-23(2,3)31-22(30)26-19(21(28)29)11-14-27-13-10-16(15-27)6-8-18-9-7-17-5-4-12-24-20(17)25-18/h7,9,16,19H,4-6,8,10-15H2,1-3H3,(H,24,25)(H,26,30)(H,28,29)/t16-,19+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM601388 ((S)-2-benzamido-4-((R)-3-(2-(5,6,7,8- | US11634418...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1ccccc1 |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448745 ((S)-2-benzamido-4-((R)-3-(2-(5,6,7,8- | US10696672...) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1ccccc1 |r| Show InChI InChI=1S/C25H32N4O3/c30-24(20-5-2-1-3-6-20)28-22(25(31)32)13-16-29-15-12-18(17-29)8-10-21-11-9-19-7-4-14-26-23(19)27-21/h1-3,5-6,9,11,18,22H,4,7-8,10,12-17H2,(H,26,27)(H,28,30)(H,31,32)/t18-,22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448757 ((S)-2-(2,6-dimethylbenzamido)-4-((R)- | US10696672...) Show SMILES Cc1cccc(C)c1C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C27H36N4O3/c1-18-5-3-6-19(2)24(18)26(32)30-23(27(33)34)13-16-31-15-12-20(17-31)8-10-22-11-9-21-7-4-14-28-25(21)29-22/h3,5-6,9,11,20,23H,4,7-8,10,12-17H2,1-2H3,(H,28,29)(H,30,32)(H,33,34)/t20-,23+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448759 ((R)-2-(2,6-dimethylbenzamido)-4-((R)- | US10696672...) Show SMILES Cc1cccc(C)c1C(=O)N[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C27H36N4O3/c1-18-5-3-6-19(2)24(18)26(32)30-23(27(33)34)13-16-31-15-12-20(17-31)8-10-22-11-9-21-7-4-14-28-25(21)29-22/h3,5-6,9,11,20,23H,4,7-8,10,12-17H2,1-2H3,(H,28,29)(H,30,32)(H,33,34)/t20-,23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448760 ((S)-2-(2-chloro-3-fluorobenzamido)-4- | US10696672...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(F)c1Cl |r| Show InChI InChI=1S/C25H30ClFN4O3/c26-22-19(4-1-5-20(22)27)24(32)30-21(25(33)34)11-14-31-13-10-16(15-31)6-8-18-9-7-17-3-2-12-28-23(17)29-18/h1,4-5,7,9,16,21H,2-3,6,8,10-15H2,(H,28,29)(H,30,32)(H,33,34)/t16-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448761 ((S)-2-(2,6-dichlorobenzamido)-4-((R)- | US10696672...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1c(Cl)cccc1Cl |r| Show InChI InChI=1S/C25H30Cl2N4O3/c26-19-4-1-5-20(27)22(19)24(32)30-21(25(33)34)11-14-31-13-10-16(15-31)6-8-18-9-7-17-3-2-12-28-23(17)29-18/h1,4-5,7,9,16,21H,2-3,6,8,10-15H2,(H,28,29)(H,30,32)(H,33,34)/t16-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448766 (US10696672, Compound 7a | US11634418, Compound 7a) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1c(Cl)cc(cc1Cl)C#N |r| Show InChI InChI=1S/C26H29Cl2N5O3/c27-20-12-17(14-29)13-21(28)23(20)25(34)32-22(26(35)36)8-11-33-10-7-16(15-33)3-5-19-6-4-18-2-1-9-30-24(18)31-19/h4,6,12-13,16,22H,1-3,5,7-11,15H2,(H,30,31)(H,32,34)(H,35,36)/t16-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448767 (US10696672, Compound 7c | US11634418, Compound 7c) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1c(Cl)cc(cc1Cl)C#N |r| Show InChI InChI=1S/C26H29Cl2N5O3/c27-20-12-17(14-29)13-21(28)23(20)25(34)32-22(26(35)36)8-11-33-10-7-16(15-33)3-5-19-6-4-18-2-1-9-30-24(18)31-19/h4,6,12-13,16,22H,1-3,5,7-11,15H2,(H,30,31)(H,32,34)(H,35,36)/t16-,22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448768 ((S)-4-((R)-3-(2-(5,6,7,8-tetrahydro-1,8- | US10696...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1ccccc1C(F)(F)F |r| Show InChI InChI=1S/C26H31F3N4O3/c27-26(28,29)21-6-2-1-5-20(21)24(34)32-22(25(35)36)12-15-33-14-11-17(16-33)7-9-19-10-8-18-4-3-13-30-23(18)31-19/h1-2,5-6,8,10,17,22H,3-4,7,9,11-16H2,(H,30,31)(H,32,34)(H,35,36)/t17-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448771 ((S)-4-((R)-3-(2-(5,6,7,8-tetrahydro-1,8- | US10696...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C26H31F3N4O3/c27-26(28,29)20-5-1-3-19(15-20)24(34)32-22(25(35)36)11-14-33-13-10-17(16-33)6-8-21-9-7-18-4-2-12-30-23(18)31-21/h1,3,5,7,9,15,17,22H,2,4,6,8,10-14,16H2,(H,30,31)(H,32,34)(H,35,36)/t17-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448772 ((S)-4-((R)-3-(2-(5,6,7,8-tetrahydro-1,8- | US10696...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C26H31F3N4O3/c27-26(28,29)20-7-4-19(5-8-20)24(34)32-22(25(35)36)12-15-33-14-11-17(16-33)3-9-21-10-6-18-2-1-13-30-23(18)31-21/h4-8,10,17,22H,1-3,9,11-16H2,(H,30,31)(H,32,34)(H,35,36)/t17-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448774 ((S)-2-(2,6-dichlorobenzamido)-4-((R)- | US10696672...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cc(OC(F)(F)F)ccc1Cl |r| Show InChI InChI=1S/C26H30ClF3N4O4/c27-21-8-7-19(38-26(28,29)30)14-20(21)24(35)33-22(25(36)37)10-13-34-12-9-16(15-34)3-5-18-6-4-17-2-1-11-31-23(17)32-18/h4,6-8,14,16,22H,1-3,5,9-13,15H2,(H,31,32)(H,33,35)(H,36,37)/t16-,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM601447 ((S)-2-(3-(3,5-dimethyl-1H-pyrazol-1- | US11634418,...) Show SMILES Cc1cc(C)n(n1)-c1cccc(c1)C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448777 ((R)-2-(3-(3,5-dimethyl-1H-pyrazol-1- | US10696672,...) Show SMILES Cc1cc(C)n(n1)-c1cccc(c1)C(=O)N[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C30H38N6O3/c1-20-17-21(2)36(34-20)26-7-3-5-24(18-26)29(37)33-27(30(38)39)13-16-35-15-12-22(19-35)8-10-25-11-9-23-6-4-14-31-28(23)32-25/h3,5,7,9,11,17-18,22,27H,4,6,8,10,12-16,19H2,1-2H3,(H,31,32)(H,33,37)(H,38,39)/t22-,27-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM601447 ((S)-2-(3-(3,5-dimethyl-1H-pyrazol-1- | US11634418,...) Show SMILES Cc1cc(C)n(n1)-c1cccc(c1)C(=O)N[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448777 ((R)-2-(3-(3,5-dimethyl-1H-pyrazol-1- | US10696672,...) Show SMILES Cc1cc(C)n(n1)-c1cccc(c1)C(=O)N[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)C(O)=O |r| Show InChI InChI=1S/C30H38N6O3/c1-20-17-21(2)36(34-20)26-7-3-5-24(18-26)29(37)33-27(30(38)39)13-16-35-15-12-22(19-35)8-10-25-11-9-23-6-4-14-31-28(23)32-25/h3,5,7,9,11,17-18,22,27H,4,6,8,10,12-16,19H2,1-2H3,(H,31,32)(H,33,37)(H,38,39)/t22-,27-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448779 ((S)-2-(3-morpholinobenzamido)-4- | US10696672, Com...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1cccc(c1)N1CCOCC1 |r| Show InChI InChI=1S/C29H39N5O4/c35-28(23-3-1-5-25(19-23)34-15-17-38-18-16-34)32-26(29(36)37)11-14-33-13-10-21(20-33)6-8-24-9-7-22-4-2-12-30-27(22)31-24/h1,3,5,7,9,19,21,26H,2,4,6,8,10-18,20H2,(H,30,31)(H,32,35)(H,36,37)/t21-,26+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448782 ((S)-2-(isonicotinamido)-4-((R)-3-(2- | US10696672,...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1ccncc1 |r| Show InChI InChI=1S/C24H31N5O3/c30-23(19-7-12-25-13-8-19)28-21(24(31)32)10-15-29-14-9-17(16-29)3-5-20-6-4-18-2-1-11-26-22(18)27-20/h4,6-8,12-13,17,21H,1-3,5,9-11,14-16H2,(H,26,27)(H,28,30)(H,31,32)/t17-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448784 ((S)-2-(3,5-dichloroisonicotinamido)-4- | US1069667...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1c(Cl)cncc1Cl |r| Show InChI InChI=1S/C24H29Cl2N5O3/c25-18-12-27-13-19(26)21(18)23(32)30-20(24(33)34)8-11-31-10-7-15(14-31)3-5-17-6-4-16-2-1-9-28-22(16)29-17/h4,6,12-13,15,20H,1-3,5,7-11,14H2,(H,28,29)(H,30,32)(H,33,34)/t15-,20+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448785 ((R)-2-(3,5-dichloroisonicotinamido)-4- | US1069667...) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)c1c(Cl)cncc1Cl |r| Show InChI InChI=1S/C24H29Cl2N5O3/c25-18-12-27-13-19(26)21(18)23(32)30-20(24(33)34)8-11-31-10-7-15(14-31)3-5-17-6-4-16-2-1-9-28-22(16)29-17/h4,6,12-13,15,20H,1-3,5,7-11,14H2,(H,28,29)(H,30,32)(H,33,34)/t15-,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448786 ((S)-2-(4,4-difluorocyclohexane-1- | US10696672, Co...) Show SMILES OC(=O)[C@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)C1CCC(F)(F)CC1 |r| Show InChI InChI=1S/C25H36F2N4O3/c26-25(27)11-7-19(8-12-25)23(32)30-21(24(33)34)10-15-31-14-9-17(16-31)3-5-20-6-4-18-2-1-13-28-22(18)29-20/h4,6,17,19,21H,1-3,5,7-16H2,(H,28,29)(H,30,32)(H,33,34)/t17-,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-6 (Homo sapiens (Human))	BDBM448787 ((R)-2-(4,4-difluorocyclohexane-1- | US10696672, Co...) Show SMILES OC(=O)[C@@H](CCN1CC[C@@H](CCc2ccc3CCCNc3n2)C1)NC(=O)C1CCC(F)(F)CC1 |r| Show InChI InChI=1S/C25H36F2N4O3/c26-25(27)11-7-19(8-12-25)23(32)30-21(24(33)34)10-15-31-14-9-17(16-31)3-5-20-6-4-18-2-1-13-28-22(18)29-20/h4,6,17,19,21H,1-3,5,7-16H2,(H,28,29)(H,30,32)(H,33,34)/t17-,21-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22J6GS4
					More data for this Ligand-Target Pair

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