Compile Data Set for Download or QSAR

Found 16 hits of ki for UniProtKB: P18510   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50331042 (2-(2-(((4R,8S,11S)-11-amino-8-(4-hydroxybenzyl)-6,...) Show SMILES N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r| Show InChI InChI=1S/C26H32N4O6S2/c27-21-9-10-37-38-15-22(26(36)28-14-18-4-2-1-3-17(18)12-24(33)34)30-23(32)13-19(29-25(21)35)11-16-5-7-20(31)8-6-16/h1-8,19,21-22,31H,9-15,27H2,(H,28,36)(H,29,35)(H,30,32)(H,33,34)/t19-,21-,22-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50553093 (CHEMBL4762305) Show SMILES N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(N)=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50553094 (CHEMBL4761376) Show SMILES N[C@H]1CNC(=O)CC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50553090 (CHEMBL4744066) Show SMILES OC(=O)Cc1ccccc1CNC(=O)[C@@H]1CSSCCCCN[C@@H](Cc2ccc(O)cc2)CC(=O)N1 |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50553092 (CHEMBL4753417) Show SMILES N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(F)cc2)NC1=O)C(=O)NCc1ccccc1CC(N)=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	201	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50553095 (CHEMBL4745618) Show SMILES N[C@H]1CCC(=O)NCC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	674	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50553096 (CHEMBL4787513) Show SMILES N[C@H]1CCNC(=O)CC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)NCc1ccccc1CC(O)=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	887	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50553091 (CHEMBL4778960) Show SMILES N[C@H]1CCSSC[C@H](NC(=O)C[C@H](Cc2ccc(O)cc2)NC1)C(=O)NCc1ccccc1CC(N)=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.25E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to recombinant full length human IRAP expressed in HEK293T cells using Leu-MCA as substrate				Citation and Details Article DOI: 10.1039/c9md00485h BindingDB Entry DOI: 10.7270/Q2377DB2
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529330 (CHEMBL4527760) Show SMILES CCCC[C@H](N)C(=O)NNc1ccc(cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C31H35N5O4/c1-2-3-12-26(32)30(38)36-35-24-16-14-22(15-17-24)29(37)34-28(31(39)40-20-21-9-5-4-6-10-21)18-23-19-33-27-13-8-7-11-25(23)27/h4-11,13-17,19,26,28,33,35H,2-3,12,18,20,32H2,1H3,(H,34,37)(H,36,38)/t26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529329 (CHEMBL4560993) Show SMILES CCCC[C@H](N)C(=O)Nc1cccc(c1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C31H34N4O4/c1-2-3-15-26(32)30(37)34-24-13-9-12-22(17-24)29(36)35-28(31(38)39-20-21-10-5-4-6-11-21)18-23-19-33-27-16-8-7-14-25(23)27/h4-14,16-17,19,26,28,33H,2-3,15,18,20,32H2,1H3,(H,34,37)(H,35,36)/t26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529320 (CHEMBL4540943) Show SMILES CCCC[C@H](N)C(=O)NNc1cccc(c1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C31H35N5O4/c1-2-3-15-26(32)30(38)36-35-24-13-9-12-22(17-24)29(37)34-28(31(39)40-20-21-10-5-4-6-11-21)18-23-19-33-27-16-8-7-14-25(23)27/h4-14,16-17,19,26,28,33,35H,2-3,15,18,20,32H2,1H3,(H,34,37)(H,36,38)/t26-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529322 (CHEMBL4466281) Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C30H33N5O4/c1-2-3-12-24(31)29(37)35-27-17-21(14-15-32-27)28(36)34-26(30(38)39-19-20-9-5-4-6-10-20)16-22-18-33-25-13-8-7-11-23(22)25/h4-11,13-15,17-18,24,26,33H,2-3,12,16,19,31H2,1H3,(H,34,36)(H,32,35,37)/t24-,26-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529326 (CHEMBL4557197) Show SMILES Oc1cccn(CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OCc2ccccc2)c1=O |r| Show InChI InChI=1S/C25H23N3O5/c29-22-11-6-12-28(24(22)31)15-23(30)27-21(25(32)33-16-17-7-2-1-3-8-17)13-18-14-26-20-10-5-4-9-19(18)20/h1-12,14,21,26,29H,13,15-16H2,(H,27,30)/t21-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529328 (CHEMBL4475441) Show SMILES COc1cccn(CC(=O)NCCc2ccc(cc2)-c2ccccc2)c1=S Show InChI InChI=1S/C22H22N2O2S/c1-26-20-8-5-15-24(22(20)27)16-21(25)23-14-13-17-9-11-19(12-10-17)18-6-3-2-4-7-18/h2-12,15H,13-14,16H2,1H3,(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529324 (CHEMBL4445197) Show SMILES Oc1cccn(CC(=O)NCCc2ccc(cc2)-c2ccccc2)c1=O Show InChI InChI=1S/C21H20N2O3/c24-19-7-4-14-23(21(19)26)15-20(25)22-13-12-16-8-10-18(11-9-16)17-5-2-1-3-6-17/h1-11,14,24H,12-13,15H2,(H,22,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair
Interleukin-1 receptor antagonist protein (Homo sapiens)	BDBM50529325 (CHEMBL4436776) Show SMILES CC(C)[C@H](NC(=O)Cn1cccc(O)c1=O)C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C19H22N2O5/c1-13(2)17(19(25)26-12-14-7-4-3-5-8-14)20-16(23)11-21-10-6-9-15(22)18(21)24/h3-10,13,17,22H,11-12H2,1-2H3,(H,20,23)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.76E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Centre for Scientific Research "Demokritos" Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115177 BindingDB Entry DOI: 10.7270/Q2FN19NT
					More data for this Ligand-Target Pair