Compile Data Set for Download or QSAR

Found 128 hits with Last Name = 'sekiguchi' and Initial = 'h'   

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
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264003 (CHEMBL4093348) Show SMILES CN1[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N(C)[C@@H](Cc2cccc3ccccc23)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O |r| Show InChI InChI=1S/C49H58N10O7/c1-58-41(17-9-25-54-49(52)66)44(62)57-40(28-31-18-21-32-10-3-4-12-34(32)26-31)47(65)59(2)42(29-35-14-7-13-33-11-5-6-15-37(33)35)45(63)56-39(27-30-19-22-36(60)23-20-30)43(61)55-38(46(58)64)16-8-24-53-48(50)51/h3-7,10-15,18-23,26,38-42,60H,8-9,16-17,24-25,27-29H2,1-2H3,(H,55,61)(H,56,63)(H,57,62)(H4,50,51,53)(H3,52,54,66)/t38-,39+,40-,41-,42-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263987 (CHEMBL4086307) Show SMILES [H][C@@]12Cc3ccccc3N1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C44H52N10O7/c1-53-36(13-7-21-49-44(47)61)39(57)52-34(24-27-14-17-28-8-2-3-9-29(28)22-27)42(60)54-35-12-5-4-10-30(35)25-37(54)40(58)51-33(23-26-15-18-31(55)19-16-26)38(56)50-32(41(53)59)11-6-20-48-43(45)46/h2-5,8-10,12,14-19,22,32-34,36-37,55H,6-7,11,13,20-21,23-25H2,1H3,(H,50,56)(H,51,58)(H,52,57)(H4,45,46,48)(H3,47,49,61)/t32-,33+,34-,36-,37-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263973 (CHEMBL4088071) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@@H](CS)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C37H46N8O6S/c1-44-30(8-4-16-40-37(38)39)33(48)42-28(20-23-10-13-24-6-2-3-7-25(24)18-23)36(51)45-17-5-9-31(45)34(49)41-27(19-22-11-14-26(46)15-12-22)32(47)43-29(21-52)35(44)50/h2-3,6-7,10-15,18,27-31,46,52H,4-5,8-9,16-17,19-21H2,1H3,(H,41,49)(H,42,48)(H,43,47)(H4,38,39,40)/t27-,28+,29-,30+,31+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50165272 (8-(6-Bromo-benzo[1,3]dioxol-5-ylsulfanyl)-9-pent-4...) Show SMILES Nc1ncnc2n(CCCC#C)c(Sc3cc4OCOc4cc3Br)nc12 Show InChI InChI=1S/C17H14BrN5O2S/c1-2-3-4-5-23-16-14(15(19)20-8-21-16)22-17(23)26-13-7-12-11(6-10(13)18)24-9-25-12/h1,6-8H,3-5,9H2,(H2,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Displacement of biotin-labeled geldanamycin from N-terminal His-tagged human recombinant HSP90alpha expressed in Escherichia coli				Bioorg Med Chem 18: 5732-7 (2010) Article DOI: 10.1016/j.bmc.2010.05.075 BindingDB Entry DOI: 10.7270/Q2JQ117R
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263986 (CHEMBL4102699) Show SMILES [H][C@]12C[C@]3([H])N(C(=O)[C@H](Cc4ccc5ccccc5c4)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc4ccc(O)cc4)NC3=O)[C@@]1([H])CCCC2 |r| Show InChI InChI=1S/C44H58N10O7/c1-53-36(13-7-21-49-44(47)61)39(57)52-34(24-27-14-17-28-8-2-3-9-29(28)22-27)42(60)54-35-12-5-4-10-30(35)25-37(54)40(58)51-33(23-26-15-18-31(55)19-16-26)38(56)50-32(41(53)59)11-6-20-48-43(45)46/h2-3,8-9,14-19,22,30,32-37,55H,4-7,10-13,20-21,23-25H2,1H3,(H,50,56)(H,51,58)(H,52,57)(H4,45,46,48)(H3,47,49,61)/t30-,32-,33+,34-,35-,36-,37-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264057 (CHEMBL4083207) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccccc1F)NC2=O |r| Show InChI InChI=1S/C40H51FN10O6/c1-50-32(14-7-19-46-40(44)57)35(53)49-31(22-24-16-17-25-9-2-3-10-26(25)21-24)38(56)51-20-8-15-33(51)36(54)48-30(23-27-11-4-5-12-28(27)41)34(52)47-29(37(50)55)13-6-18-45-39(42)43/h2-5,9-12,16-17,21,29-33H,6-8,13-15,18-20,22-23H2,1H3,(H,47,52)(H,48,54)(H,49,53)(H4,42,43,45)(H3,44,46,57)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263941 (CHEMBL4092022) Show SMILES CN1[C@@H](CCCCNC(N)=N)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N(C)[C@@H](Cc2cccc3ccccc23)C(=O)N[C@H](Cc2ccccc2F)C(=O)N[C@@H](CCCCNC(N)=N)C1=O |r| Show InChI InChI=1S/C51H62FN11O5/c1-62-43(23-10-12-27-58-51(55)56)46(65)61-42(29-32-24-25-33-14-3-4-16-35(33)28-32)49(68)63(2)44(31-36-19-13-18-34-15-5-7-20-38(34)36)47(66)60-41(30-37-17-6-8-21-39(37)52)45(64)59-40(48(62)67)22-9-11-26-57-50(53)54/h3-8,13-21,24-25,28,40-44H,9-12,22-23,26-27,29-31H2,1-2H3,(H,59,64)(H,60,66)(H,61,65)(H4,53,54,57)(H4,55,56,58)/t40-,41+,42-,43-,44-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50323786 (8-(6-Bromo-3,4-methylenedioxyphenylthio)-9-[{1-(3-...) Show SMILES Nc1ncnc2n(CCCc3cn(CCCO)nn3)c(Sc3cc4OCOc4cc3Br)nc12 Show InChI InChI=1S/C20H21BrN8O3S/c21-13-7-14-15(32-11-31-14)8-16(13)33-20-25-17-18(22)23-10-24-19(17)29(20)5-1-3-12-9-28(27-26-12)4-2-6-30/h7-10,30H,1-6,11H2,(H2,22,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	490	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Displacement of biotin-labeled geldanamycin from N-terminal His-tagged human recombinant HSP90alpha expressed in Escherichia coli				Bioorg Med Chem 18: 5732-7 (2010) Article DOI: 10.1016/j.bmc.2010.05.075 BindingDB Entry DOI: 10.7270/Q2JQ117R
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50323787 (8-(6-Bromo-3,4-methylenedioxyphenylthio)-9-[{1-(3-...) Show SMILES Nc1ncnc2n(CCCCc3cn(CCCO)nn3)c(Sc3cc4OCOc4cc3Br)nc12 Show InChI InChI=1S/C21H23BrN8O3S/c22-14-8-15-16(33-12-32-15)9-17(14)34-21-26-18-19(23)24-11-25-20(18)30(21)6-2-1-4-13-10-29(28-27-13)5-3-7-31/h8-11,31H,1-7,12H2,(H2,23,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Displacement of biotin-labeled geldanamycin from N-terminal His-tagged human recombinant HSP90alpha expressed in Escherichia coli				Bioorg Med Chem 18: 5732-7 (2010) Article DOI: 10.1016/j.bmc.2010.05.075 BindingDB Entry DOI: 10.7270/Q2JQ117R
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264098 (CHEMBL4101089) Show SMILES CN1[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N(C)[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O |r| Show InChI InChI=1S/C47H57N11O7/c1-57-39(14-8-22-52-47(50)65)42(61)56-38(25-29-15-18-30-9-3-4-10-31(30)23-29)45(64)58(2)40(26-32-27-53-35-12-6-5-11-34(32)35)43(62)55-37(24-28-16-19-33(59)20-17-28)41(60)54-36(44(57)63)13-7-21-51-46(48)49/h3-6,9-12,15-20,23,27,36-40,53,59H,7-8,13-14,21-22,24-26H2,1-2H3,(H,54,60)(H,55,62)(H,56,61)(H4,48,49,51)(H3,50,52,65)/t36-,37+,38-,39-,40-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263985 (CHEMBL4078445) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1csc3ccccc13)NC2=O |r| Show InChI InChI=1S/C42H52N10O6S/c1-51-33(13-7-19-47-42(45)58)37(54)50-32(22-25-16-17-26-9-2-3-10-27(26)21-25)40(57)52-20-8-14-34(52)38(55)49-31(23-28-24-59-35-15-5-4-11-29(28)35)36(53)48-30(39(51)56)12-6-18-46-41(43)44/h2-5,9-11,15-17,21,24,30-34H,6-8,12-14,18-20,22-23H2,1H3,(H,48,53)(H,49,55)(H,50,54)(H4,43,44,46)(H3,45,47,58)/t30-,31+,32-,33-,34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263977 (CHEMBL4071724) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCCNC(N)=N)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C41H55N11O6/c1-51-33(11-4-5-19-46-40(42)43)36(55)50-32(24-26-13-16-27-8-2-3-9-28(27)22-26)39(58)52-21-7-12-34(52)37(56)49-31(23-25-14-17-29(53)18-15-25)35(54)48-30(38(51)57)10-6-20-47-41(44)45/h2-3,8-9,13-18,22,30-34,53H,4-7,10-12,19-21,23-24H2,1H3,(H,48,54)(H,49,56)(H,50,55)(H4,42,43,46)(H4,44,45,47)/t30-,31+,32-,33-,34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263992 (CHEMBL4077750) Show SMILES CN1[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O |r| Show InChI InChI=1S/C45H56N10O7/c1-54-37(15-9-23-50-45(48)62)40(58)53-36(26-30-16-19-31-12-6-7-13-32(31)24-30)43(61)55(2)38(27-28-10-4-3-5-11-28)41(59)52-35(25-29-17-20-33(56)21-18-29)39(57)51-34(42(54)60)14-8-22-49-44(46)47/h3-7,10-13,16-21,24,34-38,56H,8-9,14-15,22-23,25-27H2,1-2H3,(H,51,57)(H,52,59)(H,53,58)(H4,46,47,49)(H3,48,50,62)/t34-,35+,36-,37-,38-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50323780 (9,9'-(3,3'-(1,1'-(3,6,9,12,15-pentaoxaheptadecane-...) Show SMILES Nc1ncnc2n(CCCc3cn(CCOCCOCCOCCOCCOCCn4cc(CCCn5c(Sc6cc7OCOc7cc6Br)nc6c(N)ncnc56)nn4)nn3)c(Sc3cc4OCOc4cc3Br)nc12 Show InChI InChI=1S/C46H52Br2N16O9S2/c47-31-19-33-35(72-27-70-33)21-37(31)74-45-55-39-41(49)51-25-53-43(39)63(45)5-1-3-29-23-61(59-57-29)7-9-65-11-13-67-15-17-69-18-16-68-14-12-66-10-8-62-24-30(58-60-62)4-2-6-64-44-40(42(50)52-26-54-44)56-46(64)75-38-22-36-34(20-32(38)48)71-28-73-36/h19-26H,1-18,27-28H2,(H2,49,51,53)(H2,50,52,54)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Displacement of biotin-labeled geldanamycin from N-terminal His-tagged human recombinant HSP90alpha expressed in Escherichia coli				Bioorg Med Chem 18: 5732-7 (2010) Article DOI: 10.1016/j.bmc.2010.05.075 BindingDB Entry DOI: 10.7270/Q2JQ117R
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263984 (CHEMBL4067542) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc3ccccc3c1)NC2=O |r| Show InChI InChI=1S/C44H54N10O6/c1-53-36(14-7-21-49-44(47)60)39(56)52-35(26-28-17-19-30-10-3-5-12-32(30)24-28)42(59)54-22-8-15-37(54)40(57)51-34(25-27-16-18-29-9-2-4-11-31(29)23-27)38(55)50-33(41(53)58)13-6-20-48-43(45)46/h2-5,9-12,16-19,23-24,33-37H,6-8,13-15,20-22,25-26H2,1H3,(H,50,55)(H,51,57)(H,52,56)(H4,45,46,48)(H3,47,49,60)/t33-,34+,35-,36-,37-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263983 (CHEMBL4074806) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(cc1)C(=O)c1ccccc1)NC2=O |r| Show InChI InChI=1S/C47H56N10O7/c1-56-38(15-8-24-52-47(50)64)42(60)55-37(28-30-19-20-31-10-5-6-13-34(31)26-30)45(63)57-25-9-16-39(57)43(61)54-36(41(59)53-35(44(56)62)14-7-23-51-46(48)49)27-29-17-21-33(22-18-29)40(58)32-11-3-2-4-12-32/h2-6,10-13,17-22,26,35-39H,7-9,14-16,23-25,27-28H2,1H3,(H,53,59)(H,54,61)(H,55,60)(H4,48,49,51)(H3,50,52,64)/t35-,36+,37-,38-,39-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263982 (CHEMBL4102492) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(Br)cc1)NC2=O |r| Show InChI InChI=1S/C40H51BrN10O6/c1-50-32(10-5-19-46-40(44)57)35(53)49-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(56)51-20-6-11-33(51)36(54)48-30(22-24-13-16-28(41)17-14-24)34(52)47-29(37(50)55)9-4-18-45-39(42)43/h2-3,7-8,12-17,21,29-33H,4-6,9-11,18-20,22-23H2,1H3,(H,47,52)(H,48,54)(H,49,53)(H4,42,43,45)(H3,44,46,57)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264062 (CHEMBL4077860) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC2=O |r| Show InChI InChI=1S/C40H51ClN10O6/c1-50-32(10-5-19-46-40(44)57)35(53)49-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(56)51-20-6-11-33(51)36(54)48-30(22-24-13-16-28(41)17-14-24)34(52)47-29(37(50)55)9-4-18-45-39(42)43/h2-3,7-8,12-17,21,29-33H,4-6,9-11,18-20,22-23H2,1H3,(H,47,52)(H,48,54)(H,49,53)(H4,42,43,45)(H3,44,46,57)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50323782 (9,9'-(3,3'-(1,1'-(3,6,9,12,15,18-hexaoxaicosane-1,...) Show SMILES Nc1ncnc2n(CCCc3cn(CCOCCOCCOCCOCCOCCOCCn4cc(CCCn5c(Sc6cc7OCOc7cc6Br)nc6c(N)ncnc56)nn4)nn3)c(Sc3cc4OCOc4cc3Br)nc12 Show InChI InChI=1S/C48H56Br2N16O10S2/c49-33-21-35-37(75-29-73-35)23-39(33)77-47-57-41-43(51)53-27-55-45(41)65(47)5-1-3-31-25-63(61-59-31)7-9-67-11-13-69-15-17-71-19-20-72-18-16-70-14-12-68-10-8-64-26-32(60-62-64)4-2-6-66-46-42(44(52)54-28-56-46)58-48(66)78-40-24-38-36(22-34(40)50)74-30-76-38/h21-28H,1-20,29-30H2,(H2,51,53,55)(H2,52,54,56)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Displacement of biotin-labeled geldanamycin from N-terminal His-tagged human recombinant HSP90alpha expressed in Escherichia coli				Bioorg Med Chem 18: 5732-7 (2010) Article DOI: 10.1016/j.bmc.2010.05.075 BindingDB Entry DOI: 10.7270/Q2JQ117R
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263962 (CHEMBL4059795) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C41H55N11O6/c1-51-33(11-6-20-47-41(44)45)36(55)50-32(24-26-13-16-27-8-2-3-9-28(27)22-26)39(58)52-21-7-12-34(52)37(56)49-31(23-25-14-17-29(53)18-15-25)35(54)48-30(38(51)57)10-4-5-19-46-40(42)43/h2-3,8-9,13-18,22,30-34,53H,4-7,10-12,19-21,23-24H2,1H3,(H,48,54)(H,49,56)(H,50,55)(H4,42,43,46)(H4,44,45,47)/t30-,31+,32-,33-,34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264006 (CHEMBL4090573) Show SMILES CN1[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O |r| Show InChI InChI=1S/C46H55N11O7/c1-57-39(13-7-21-51-46(49)64)43(62)56-37(24-28-14-17-29-8-2-3-9-30(29)22-28)41(60)55-38(25-31-26-52-34-11-5-4-10-33(31)34)42(61)54-36(23-27-15-18-32(58)19-16-27)40(59)53-35(44(57)63)12-6-20-50-45(47)48/h2-5,8-11,14-19,22,26,35-39,52,58H,6-7,12-13,20-21,23-25H2,1H3,(H,53,59)(H,54,61)(H,55,60)(H,56,62)(H4,47,48,50)(H3,49,51,64)/t35-,36+,37-,38-,39-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	850	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50092206 (CHEMBL3581276) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C40H53N11O6/c1-50-32(10-5-19-46-40(43)44)35(54)49-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(57)51-20-6-11-33(51)36(55)48-30(22-24-13-16-28(52)17-14-24)34(53)47-29(37(50)56)9-4-18-45-39(41)42/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,53)(H,48,55)(H,49,54)(H4,41,42,45)(H4,43,44,46)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	860	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264004 (CHEMBL4071592) Show SMILES CN1[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N(C)[C@@H](Cc2csc3ccccc23)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O |r| Show InChI InChI=1S/C47H56N10O7S/c1-56-38(13-8-22-52-47(50)64)42(60)55-37(25-29-15-18-30-9-3-4-10-31(30)23-29)45(63)57(2)39(26-32-27-65-40-14-6-5-11-34(32)40)43(61)54-36(24-28-16-19-33(58)20-17-28)41(59)53-35(44(56)62)12-7-21-51-46(48)49/h3-6,9-11,14-20,23,27,35-39,58H,7-8,12-13,21-22,24-26H2,1-2H3,(H,53,59)(H,54,61)(H,55,60)(H4,48,49,51)(H3,50,52,64)/t35-,36+,37-,38-,39-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50323784 (9,9'-(3,3'-(1,1'-(3,6,9,12,15,18,21-heptaoxatricos...) Show SMILES Nc1ncnc2n(CCCc3cn(CCOCCOCCOCCOCCOCCOCCOCCn4cc(CCCn5c(Sc6cc7OCOc7cc6Br)nc6c(N)ncnc56)nn4)nn3)c(Sc3cc4OCOc4cc3Br)nc12 Show InChI InChI=1S/C50H60Br2N16O11S2/c51-35-23-37-39(78-31-76-37)25-41(35)80-49-59-43-45(53)55-29-57-47(43)67(49)5-1-3-33-27-65(63-61-33)7-9-69-11-13-71-15-17-73-19-21-75-22-20-74-18-16-72-14-12-70-10-8-66-28-34(62-64-66)4-2-6-68-48-44(46(54)56-30-58-48)60-50(68)81-42-26-40-38(24-36(42)52)77-32-79-40/h23-30H,1-22,31-32H2,(H2,53,55,57)(H2,54,56,58)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Displacement of biotin-labeled geldanamycin from N-terminal His-tagged human recombinant HSP90alpha expressed in Escherichia coli				Bioorg Med Chem 18: 5732-7 (2010) Article DOI: 10.1016/j.bmc.2010.05.075 BindingDB Entry DOI: 10.7270/Q2JQ117R
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263978 (CHEMBL4072745) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccccc1)NC2=O |r| Show InChI InChI=1S/C40H52N10O6/c1-49-32(15-8-20-45-40(43)56)35(52)48-31(24-26-17-18-27-12-5-6-13-28(27)22-26)38(55)50-21-9-16-33(50)36(53)47-30(23-25-10-3-2-4-11-25)34(51)46-29(37(49)54)14-7-19-44-39(41)42/h2-6,10-13,17-18,22,29-33H,7-9,14-16,19-21,23-24H2,1H3,(H,46,51)(H,47,53)(H,48,52)(H4,41,42,44)(H3,43,45,56)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263981 (CHEMBL4102116) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(F)cc1)NC2=O |r| Show InChI InChI=1S/C40H51FN10O6/c1-50-32(10-5-19-46-40(44)57)35(53)49-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(56)51-20-6-11-33(51)36(54)48-30(22-24-13-16-28(41)17-14-24)34(52)47-29(37(50)55)9-4-18-45-39(42)43/h2-3,7-8,12-17,21,29-33H,4-6,9-11,18-20,22-23H2,1H3,(H,47,52)(H,48,54)(H,49,53)(H4,42,43,45)(H3,44,46,57)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263976 (CHEMBL4063107) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCN)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C39H51N9O6/c1-47-32(10-4-18-40)35(51)46-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(54)48-20-6-11-33(48)36(52)45-30(22-24-13-16-28(49)17-14-24)34(50)44-29(37(47)53)9-5-19-43-39(41)42/h2-3,7-8,12-17,21,29-33,49H,4-6,9-11,18-20,22-23,40H2,1H3,(H,44,50)(H,45,52)(H,46,51)(H4,41,42,43)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263980 (CHEMBL4101207) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1cccc(F)c1)NC2=O |r| Show InChI InChI=1S/C40H51FN10O6/c1-50-32(13-6-18-46-40(44)57)35(53)49-31(23-25-15-16-26-9-2-3-10-27(26)20-25)38(56)51-19-7-14-33(51)36(54)48-30(22-24-8-4-11-28(41)21-24)34(52)47-29(37(50)55)12-5-17-45-39(42)43/h2-4,8-11,15-16,20-21,29-33H,5-7,12-14,17-19,22-23H2,1H3,(H,47,52)(H,48,54)(H,49,53)(H4,42,43,45)(H3,44,46,57)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50323779 (8-(6-bromobenzo[d][1,3]dioxol-5-ylthio)-9-(hex-5-y...) Show SMILES Nc1ncnc2n(CCCCC#C)c(Sc3cc4OCOc4cc3Br)nc12 Show InChI InChI=1S/C18H16BrN5O2S/c1-2-3-4-5-6-24-17-15(16(20)21-9-22-17)23-18(24)27-14-8-13-12(7-11(14)19)25-10-26-13/h1,7-9H,3-6,10H2,(H2,20,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Displacement of biotin-labeled geldanamycin from N-terminal His-tagged human recombinant HSP90alpha expressed in Escherichia coli				Bioorg Med Chem 18: 5732-7 (2010) Article DOI: 10.1016/j.bmc.2010.05.075 BindingDB Entry DOI: 10.7270/Q2JQ117R
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264056 (CHEMBL4098734) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCNC(N)=N)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C39H51N11O6/c1-49-31(16-18-45-39(42)43)34(53)48-30(22-24-10-13-25-6-2-3-7-26(25)20-24)37(56)50-19-5-9-32(50)35(54)47-29(21-23-11-14-27(51)15-12-23)33(52)46-28(36(49)55)8-4-17-44-38(40)41/h2-3,6-7,10-15,20,28-32,51H,4-5,8-9,16-19,21-22H2,1H3,(H,46,52)(H,47,54)(H,48,53)(H4,40,41,44)(H4,42,43,45)/t28-,29+,30-,31-,32-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263991 (CHEMBL4102017) Show SMILES CSCC[C@@H]1N(C)C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O |r| Show InChI InChI=1S/C41H56N10O7S/c1-50-33(11-7-20-46-41(44)58)36(54)49-32(24-26-12-15-27-8-4-5-9-28(27)22-26)39(57)51(2)34(18-21-59-3)37(55)48-31(23-25-13-16-29(52)17-14-25)35(53)47-30(38(50)56)10-6-19-45-40(42)43/h4-5,8-9,12-17,22,30-34,52H,6-7,10-11,18-21,23-24H2,1-3H3,(H,47,53)(H,48,55)(H,49,54)(H4,42,43,45)(H3,44,46,58)/t30-,31+,32-,33-,34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264002 (CHEMBL4072634) Show SMILES CN1[C@@H](CCCNC(N)=O)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N(C)[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O |r| Show InChI InChI=1S/C45H56N10O8/c1-54-37(10-6-22-50-45(48)63)40(59)53-36(25-29-11-16-30-7-3-4-8-31(30)23-29)43(62)55(2)38(26-28-14-19-33(57)20-15-28)41(60)52-35(24-27-12-17-32(56)18-13-27)39(58)51-34(42(54)61)9-5-21-49-44(46)47/h3-4,7-8,11-20,23,34-38,56-57H,5-6,9-10,21-22,24-26H2,1-2H3,(H,51,58)(H,52,60)(H,53,59)(H4,46,47,49)(H3,48,50,63)/t34-,35+,36-,37-,38-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264097 (CHEMBL4085603) Show SMILES CC(C)C[C@@H]1N(C)C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O |r| Show InChI InChI=1S/C42H58N10O7/c1-25(2)21-35-38(56)49-32(23-26-14-17-30(53)18-15-26)36(54)48-31(11-7-19-46-41(43)44)39(57)51(3)34(12-8-20-47-42(45)59)37(55)50-33(40(58)52(35)4)24-27-13-16-28-9-5-6-10-29(28)22-27/h5-6,9-10,13-18,22,25,31-35,53H,7-8,11-12,19-21,23-24H2,1-4H3,(H,48,54)(H,49,56)(H,50,55)(H4,43,44,46)(H3,45,47,59)/t31-,32+,33-,34-,35-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263942 (CHEMBL4059514) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(cc1)[N+]([O-])=O)NC2=O |r| Show InChI InChI=1S/C40H51N11O8/c1-49-32(10-5-19-45-40(43)57)35(53)48-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(56)50-20-6-11-33(50)36(54)47-30(22-24-13-16-28(17-14-24)51(58)59)34(52)46-29(37(49)55)9-4-18-44-39(41)42/h2-3,7-8,12-17,21,29-33H,4-6,9-11,18-20,22-23H2,1H3,(H,46,52)(H,47,54)(H,48,53)(H4,41,42,44)(H3,43,45,57)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264050 (CHEMBL4103175) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@]1([H])CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C39H48N8O6/c1-45-31(9-4-18-42-39(40)41)34(49)43-30(23-25-12-15-26-7-2-3-8-27(26)21-25)36(51)46-19-5-10-32(46)35(50)44-29(22-24-13-16-28(48)17-14-24)37(52)47-20-6-11-33(47)38(45)53/h2-3,7-8,12-17,21,29-33,48H,4-6,9-11,18-20,22-23H2,1H3,(H,43,49)(H,44,50)(H4,40,41,42)/t29-,30+,31+,32+,33+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264051 (CHEMBL4061399) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C45H51N9O6/c1-53-38(12-6-20-48-45(46)47)41(57)52-36(24-28-14-17-29-8-2-3-9-30(29)22-28)44(60)54-21-7-13-39(54)42(58)50-35(23-27-15-18-32(55)19-16-27)40(56)51-37(43(53)59)25-31-26-49-34-11-5-4-10-33(31)34/h2-5,8-11,14-19,22,26,35-39,49,55H,6-7,12-13,20-21,23-25H2,1H3,(H,50,58)(H,51,56)(H,52,57)(H4,46,47,48)/t35-,36+,37+,38+,39+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263940 (CHEMBL4084265) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C40H48N10O6/c1-49-33(8-4-16-44-40(41)42)36(53)48-31(20-25-10-13-26-6-2-3-7-27(26)18-25)39(56)50-17-5-9-34(50)37(54)46-30(19-24-11-14-29(51)15-12-24)35(52)47-32(38(49)55)21-28-22-43-23-45-28/h2-3,6-7,10-15,18,22-23,30-34,51H,4-5,8-9,16-17,19-21H2,1H3,(H,43,45)(H,46,54)(H,47,52)(H,48,53)(H4,41,42,44)/t30-,31+,32+,33+,34+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263938 (CHEMBL4062559) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@@H](NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O)C(C)C |r| Show InChI InChI=1S/C39H50N8O6/c1-23(2)33-38(53)46(3)31(10-6-18-42-39(40)41)35(50)44-30(22-25-12-15-26-8-4-5-9-27(26)20-25)37(52)47-19-7-11-32(47)36(51)43-29(34(49)45-33)21-24-13-16-28(48)17-14-24/h4-5,8-9,12-17,20,23,29-33,48H,6-7,10-11,18-19,21-22H2,1-3H3,(H,43,51)(H,44,50)(H,45,49)(H4,40,41,42)/t29-,30+,31+,32+,33+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263895 (CHEMBL4073931) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C43H50N8O7/c1-50-36(8-4-20-46-43(44)45)39(55)49-35(25-28-10-15-29-6-2-3-7-30(29)22-28)42(58)51-21-5-9-37(51)40(56)47-33(23-26-11-16-31(52)17-12-26)38(54)48-34(41(50)57)24-27-13-18-32(53)19-14-27/h2-3,6-7,10-19,22,33-37,52-53H,4-5,8-9,20-21,23-25H2,1H3,(H,47,56)(H,48,54)(H,49,55)(H4,44,45,46)/t33-,34+,35+,36+,37+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263894 (CHEMBL4065322) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@@]([H])(NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O)[C@@H](C)O |r| Show InChI InChI=1S/C38H48N8O7/c1-22(47)32-37(53)45(2)30(9-5-17-41-38(39)40)34(50)43-29(21-24-11-14-25-7-3-4-8-26(25)19-24)36(52)46-18-6-10-31(46)35(51)42-28(33(49)44-32)20-23-12-15-27(48)16-13-23/h3-4,7-8,11-16,19,22,28-32,47-48H,5-6,9-10,17-18,20-21H2,1-2H3,(H,42,51)(H,43,50)(H,44,49)(H4,39,40,41)/t22-,28-,29+,30+,31+,32+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263879 (CHEMBL4092988) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CO)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C37H46N8O7/c1-44-30(8-4-16-40-37(38)39)33(49)42-28(20-23-10-13-24-6-2-3-7-25(24)18-23)36(52)45-17-5-9-31(45)34(50)41-27(19-22-11-14-26(47)15-12-22)32(48)43-29(21-46)35(44)51/h2-3,6-7,10-15,18,27-31,46-47H,4-5,8-9,16-17,19-21H2,1H3,(H,41,50)(H,42,49)(H,43,48)(H4,38,39,40)/t27-,28+,29+,30+,31+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263878 (CHEMBL4085246) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C43H50N8O6/c1-50-36(13-7-21-46-43(44)45)39(54)49-35(26-29-15-18-30-11-5-6-12-31(30)23-29)42(57)51-22-8-14-37(51)40(55)47-33(24-28-16-19-32(52)20-17-28)38(53)48-34(41(50)56)25-27-9-3-2-4-10-27/h2-6,9-12,15-20,23,33-37,52H,7-8,13-14,21-22,24-26H2,1H3,(H,47,55)(H,48,53)(H,49,54)(H4,44,45,46)/t33-,34+,35+,36+,37+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264052 (CHEMBL4071198) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C40H53N9O6/c1-48-33(11-6-20-44-40(42)43)36(52)47-32(24-26-13-16-27-8-2-3-9-28(27)22-26)39(55)49-21-7-12-34(49)37(53)46-31(23-25-14-17-29(50)18-15-25)35(51)45-30(38(48)54)10-4-5-19-41/h2-3,8-9,13-18,22,30-34,50H,4-7,10-12,19-21,23-24,41H2,1H3,(H,45,51)(H,46,53)(H,47,52)(H4,42,43,44)/t30-,31+,32-,33-,34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263855 (CHEMBL4101715) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCSC)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C39H50N8O6S/c1-46-32(9-5-18-42-39(40)41)35(50)45-31(23-25-11-14-26-7-3-4-8-27(26)21-25)38(53)47-19-6-10-33(47)36(51)44-30(22-24-12-15-28(48)16-13-24)34(49)43-29(37(46)52)17-20-54-2/h3-4,7-8,11-16,21,29-33,48H,5-6,9-10,17-20,22-23H2,1-2H3,(H,43,49)(H,44,51)(H,45,50)(H4,40,41,42)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263854 (CHEMBL4075034) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C40H52N8O6/c1-24(2)20-31-38(53)47(3)33(10-6-18-43-40(41)42)36(51)46-32(23-26-12-15-27-8-4-5-9-28(27)21-26)39(54)48-19-7-11-34(48)37(52)44-30(35(50)45-31)22-25-13-16-29(49)17-14-25/h4-5,8-9,12-17,21,24,30-34,49H,6-7,10-11,18-20,22-23H2,1-3H3,(H,44,52)(H,45,50)(H,46,51)(H4,41,42,43)/t30-,31+,32+,33+,34+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263853 (CHEMBL4063675) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@@]([H])(NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O)[C@@H](C)CC |r| Show InChI InChI=1S/C40H52N8O6/c1-4-24(2)34-39(54)47(3)32(11-7-19-43-40(41)42)36(51)45-31(23-26-13-16-27-9-5-6-10-28(27)21-26)38(53)48-20-8-12-33(48)37(52)44-30(35(50)46-34)22-25-14-17-29(49)18-15-25/h5-6,9-10,13-18,21,24,30-34,49H,4,7-8,11-12,19-20,22-23H2,1-3H3,(H,44,52)(H,45,51)(H,46,50)(H4,41,42,43)/t24-,30+,31-,32-,33-,34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264093 (CHEMBL4094069) Show SMILES [H][C@@]12Cc3[nH]c4ccccc4c3CN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C47H55N11O7/c1-57-39(13-7-21-52-47(50)65)42(61)56-38(24-28-14-17-29-8-2-3-9-30(29)22-28)45(64)58-26-33-32-10-4-5-11-34(32)53-36(33)25-40(58)43(62)55-37(23-27-15-18-31(59)19-16-27)41(60)54-35(44(57)63)12-6-20-51-46(48)49/h2-5,8-11,14-19,22,35,37-40,53,59H,6-7,12-13,20-21,23-26H2,1H3,(H,54,60)(H,55,62)(H,56,61)(H4,48,49,51)(H3,50,52,65)/t35-,37+,38-,39-,40-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263990 (CHEMBL4064038) Show SMILES [H][C@@]1([C@@H](C)CC)N(C)C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=O)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O |r| Show InChI InChI=1S/C42H58N10O7/c1-5-25(2)35-38(56)49-32(23-26-15-18-30(53)19-16-26)36(54)48-31(12-8-20-46-41(43)44)39(57)51(3)34(13-9-21-47-42(45)59)37(55)50-33(40(58)52(35)4)24-27-14-17-28-10-6-7-11-29(28)22-27/h6-7,10-11,14-19,22,25,31-35,53H,5,8-9,12-13,20-21,23-24H2,1-4H3,(H,48,54)(H,49,56)(H,50,55)(H4,43,44,46)(H3,45,47,59)/t25-,31-,32+,33-,34-,35-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50264054 (CHEMBL4095797) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCNC(N)=N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C39H51N11O6/c1-49-31(8-4-17-44-38(40)41)34(53)48-30(22-24-10-13-25-6-2-3-7-26(25)20-24)37(56)50-19-5-9-32(50)35(54)47-29(21-23-11-14-27(51)15-12-23)33(52)46-28(36(49)55)16-18-45-39(42)43/h2-3,6-7,10-15,20,28-32,51H,4-5,8-9,16-19,21-22H2,1H3,(H,46,52)(H,47,54)(H,48,53)(H4,40,41,44)(H4,42,43,45)/t28-,29+,30-,31-,32-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair
Atypical chemokine receptor 3 (Homo sapiens (Human))	BDBM50263944 (CHEMBL4068453) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCCN)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r| Show InChI InChI=1S/C39H51N9O6/c1-47-32(10-5-19-43-39(41)42)35(51)46-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(54)48-20-6-11-33(48)36(52)45-30(22-24-13-16-28(49)17-14-24)34(50)44-29(37(47)53)9-4-18-40/h2-3,7-8,12-17,21,29-33,49H,4-6,9-11,18-20,22-23,40H2,1H3,(H,44,50)(H,45,52)(H,46,51)(H4,41,42,43)/t29-,30+,31-,32-,33-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method				J Med Chem 61: 3745-3751 (2018) Article DOI: 10.1021/acs.jmedchem.8b00336 BindingDB Entry DOI: 10.7270/Q23B62M5
					More data for this Ligand-Target Pair

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