Compile Data Set for Download or QSAR

Found 61 hits with Last Name = 'rotondaro' and Initial = 'l'   

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
Substance-K receptor (Homo sapiens (Human))	BDBM50472916 (CHEMBL223221 | MEN-11690) Show SMILES Clc1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1Cl |r| Show InChI InChI=1S/C33H33Cl2N5O4/c34-25-11-10-21(15-26(25)35)14-23-19-37-30(41)12-13-31(42)39-29(17-22-18-36-27-9-5-4-8-24(22)27)33(44)40-28(32(43)38-23)16-20-6-2-1-3-7-20/h1-11,15,18,23,28-29,36H,12-14,16-17,19H2,(H,37,41)(H,38,43)(H,39,42)(H,40,44)/t23-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472916 (CHEMBL223221 | MEN-11690) Show SMILES Clc1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1Cl |r| Show InChI InChI=1S/C33H33Cl2N5O4/c34-25-11-10-21(15-26(25)35)14-23-19-37-30(41)12-13-31(42)39-29(17-22-18-36-27-9-5-4-8-24(22)27)33(44)40-28(32(43)38-23)16-20-6-2-1-3-7-20/h1-11,15,18,23,28-29,36H,12-14,16-17,19H2,(H,37,41)(H,38,43)(H,39,42)(H,40,44)/t23-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473829 (CHEMBL389459 | MEN-11995) Show SMILES O=C1C[C@@H](N2CCOCC2)C(=O)NC[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 |r| Show InChI InChI=1S/C37H42N6O5/c44-34-22-33(43-15-17-48-18-16-43)37(47)39-24-28(19-25-9-3-1-4-10-25)40-35(45)31(20-26-11-5-2-6-12-26)42-36(46)32(41-34)21-27-23-38-30-14-8-7-13-29(27)30/h1-14,23,28,31-33,38H,15-22,24H2,(H,39,47)(H,40,45)(H,41,44)(H,42,46)/t28-,31+,32+,33-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.158	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473828 (CHEMBL116812 | MEN-11990) Show SMILES O=C(CN1CCOCC1)N[C@@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CNC1=O Show InChI InChI=1S/C39H45N7O6/c47-35-22-34(44-36(48)25-46-15-17-52-18-16-46)37(49)41-24-29(19-26-9-3-1-4-10-26)42-38(50)32(20-27-11-5-2-6-12-27)45-39(51)33(43-35)21-28-23-40-31-14-8-7-13-30(28)31/h1-14,23,29,32-34,40H,15-22,24-25H2,(H,41,49)(H,42,50)(H,43,47)(H,44,48)(H,45,51)/t29-,32+,33+,34-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473824 (CHEMBL406024 | MEN-11959) Show SMILES O=C(CN1CCC(CC1)N1CCCCC1)N[C@@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)CNC1=O Show InChI InChI=1S/C45H56N8O5/c54-41-27-40(50-42(55)30-52-22-18-35(19-23-52)53-20-10-3-11-21-53)43(56)47-29-34(24-31-12-4-1-5-13-31)48-44(57)38(25-32-14-6-2-7-15-32)51-45(58)39(49-41)26-33-28-46-37-17-9-8-16-36(33)37/h1-2,4-9,12-17,28,34-35,38-40,46H,3,10-11,18-27,29-30H2,(H,47,56)(H,48,57)(H,49,54)(H,50,55)(H,51,58)/t34-,38-,39-,40+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50366377 (CHEMBL334721 | MEN-10627) Show SMILES CSCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CNC(=O)C[C@H](NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C38H48N8O7S/c1-21(2)15-27-34(49)41-26(13-14-54-3)33(48)45-30-18-32(47)40-20-31(38(53)42-27)46-35(50)28(16-22-9-5-4-6-10-22)43-36(51)29(44-37(30)52)17-23-19-39-25-12-8-7-11-24(23)25/h4-12,19,21,26-31,39H,13-18,20H2,1-3H3,(H,40,47)(H,41,49)(H,42,53)(H,43,51)(H,44,52)(H,45,48)(H,46,50)/t26-,27-,28-,29-,30-,31-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473818 (CHEMBL406287 | MEN-11842) Show SMILES OC(=O)C(F)(F)F.O=C1C[C@H](N2CCOCC2)C(=O)NC[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 |r| Show InChI InChI=1S/C37H42N6O5.C2HF3O2/c44-34-22-33(43-15-17-48-18-16-43)37(47)39-24-28(19-25-9-3-1-4-10-25)40-35(45)31(20-26-11-5-2-6-12-26)42-36(46)32(41-34)21-27-23-38-30-14-8-7-13-29(27)30;3-2(4,5)1(6)7/h1-14,23,28,31-33,38H,15-22,24H2,(H,39,47)(H,40,45)(H,41,44)(H,42,46);(H,6,7)/t28-,31+,32+,33+;/m1./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473833 (CHEMBL420859 | MEN-11830) Show SMILES O=C1C[C@H](NCc2nn[nH]n2)C(=O)NC[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 Show InChI InChI=1S/C35H38N10O4/c46-32-18-28(37-21-31-42-44-45-43-31)33(47)38-20-25(15-22-9-3-1-4-10-22)39-34(48)29(16-23-11-5-2-6-12-23)41-35(49)30(40-32)17-24-19-36-27-14-8-7-13-26(24)27/h1-14,19,25,28-30,36-37H,15-18,20-21H2,(H,38,47)(H,39,48)(H,40,46)(H,41,49)(H,42,43,44,45)/t25-,28+,29+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472917 (CHEMBL323884 | MEN-11749) Show SMILES Fc1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1F Show InChI InChI=1S/C33H33F2N5O4/c34-25-11-10-21(15-26(25)35)14-23-19-37-30(41)12-13-31(42)39-29(17-22-18-36-27-9-5-4-8-24(22)27)33(44)40-28(32(43)38-23)16-20-6-2-1-3-7-20/h1-11,15,18,23,28-29,36H,12-14,16-17,19H2,(H,37,41)(H,38,43)(H,39,42)(H,40,44)/t23-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472917 (CHEMBL323884 | MEN-11749) Show SMILES Fc1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1F Show InChI InChI=1S/C33H33F2N5O4/c34-25-11-10-21(15-26(25)35)14-23-19-37-30(41)12-13-31(42)39-29(17-22-18-36-27-9-5-4-8-24(22)27)33(44)40-28(32(43)38-23)16-20-6-2-1-3-7-20/h1-11,15,18,23,28-29,36H,12-14,16-17,19H2,(H,37,41)(H,38,43)(H,39,42)(H,40,44)/t23-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50404020 (CHEMBL435324 | MEN-11558) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CN1 |r| Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50404020 (CHEMBL435324 | MEN-11558) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CN1 |r| Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472911 (CHEMBL407782 | MEN-11420) Show SMILES [H][C@]12CNC(=O)C[C@]([H])(NC(=O)[C@H](CC(=O)N[C@@H]3O[C@H](CO)[C@@H](O)[C@H](CO)[C@H]3NC(C)=O)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C46H60N10O13/c1-22(2)13-29-40(63)54-33(17-37(61)56-46-38(49-23(3)59)27(20-57)39(62)35(21-58)69-46)44(67)53-32-16-36(60)48-19-34(45(68)50-29)55-41(64)30(14-24-9-5-4-6-10-24)51-42(65)31(52-43(32)66)15-25-18-47-28-12-8-7-11-26(25)28/h4-12,18,22,27,29-35,38-39,46-47,57-58,62H,13-17,19-21H2,1-3H3,(H,48,60)(H,49,59)(H,50,68)(H,51,65)(H,52,66)(H,53,67)(H,54,63)(H,55,64)(H,56,61)/t27-,29+,30+,31+,32+,33+,34+,35-,38-,39+,46-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473823 (CHEMBL420308 | MEN-11691) Show SMILES N[C@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CNC1=O Show InChI InChI=1S/C33H36N6O4/c34-26-18-30(40)38-29(17-23-19-35-27-14-8-7-13-25(23)27)33(43)39-28(16-22-11-5-2-6-12-22)32(42)37-24(20-36-31(26)41)15-21-9-3-1-4-10-21/h1-14,19,24,26,28-29,35H,15-18,20,34H2,(H,36,41)(H,37,42)(H,38,40)(H,39,43)/t24-,26+,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473822 (CHEMBL438559 | MEN-11799) Show SMILES N[C@H]1CC(=O)NC[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O Show InChI InChI=1S/C33H36N6O4/c34-26-18-30(40)36-20-24(15-21-9-3-1-4-10-21)37-32(42)28(16-22-11-5-2-6-12-22)39-33(43)29(38-31(26)41)17-23-19-35-27-14-8-7-13-25(23)27/h1-14,19,24,26,28-29,35H,15-18,20,34H2,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t24-,26+,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473836 (CHEMBL324313 | MEN-11701) Show SMILES Fc1ccc2NCC(C[C@@H]3NC(=O)CCC(=O)NC[C@@H](Cc4ccccc4)NC(=O)[C@H](Cc4ccccc4)NC3=O)c2c1 Show InChI InChI=1S/C33H36FN5O4/c34-24-11-12-27-26(18-24)23(19-35-27)17-29-33(43)39-28(16-22-9-5-2-6-10-22)32(42)37-25(15-21-7-3-1-4-8-21)20-36-30(40)13-14-31(41)38-29/h1-12,18,23,25,28-29,35H,13-17,19-20H2,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t23?,25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473830 (CHEMBL323677 | MEN-11703) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)CN1 Show InChI InChI=1S/C35H36N6O4/c42-32-14-15-33(43)40-31(18-24-20-37-29-13-7-5-11-27(24)29)35(45)41-30(16-22-8-2-1-3-9-22)34(44)39-25(21-38-32)17-23-19-36-28-12-6-4-10-26(23)28/h1-13,19-20,25,30-31,36-37H,14-18,21H2,(H,38,42)(H,39,44)(H,40,43)(H,41,45)/t25-,30+,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473839 (CHEMBL116871 | MEN-11987) Show SMILES O=C(Cn1cnnn1)N[C@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)NC1=O Show InChI InChI=1S/C35H36N10O5/c46-31-18-29(39-32(47)20-45-21-37-43-44-45)35(50)42-30(16-23-11-5-2-6-12-23)41-34(49)27(15-22-9-3-1-4-10-22)40-33(48)28(38-31)17-24-19-36-26-14-8-7-13-25(24)26/h1-14,19,21,27-30,36H,15-18,20H2,(H,38,46)(H,39,47)(H,40,48)(H,41,49)(H,42,50)/t27-,28-,29-,30-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473821 (CHEMBL114068 | MEN-11986) Show SMILES NC(=N)NCC(=O)N[C@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CNC1=O Show InChI InChI=1S/C36H41N9O5/c37-36(38)41-21-32(47)44-30-18-31(46)43-29(17-24-19-39-27-14-8-7-13-26(24)27)35(50)45-28(16-23-11-5-2-6-12-23)34(49)42-25(20-40-33(30)48)15-22-9-3-1-4-10-22/h1-14,19,25,28-30,39H,15-18,20-21H2,(H,40,48)(H,42,49)(H,43,46)(H,44,47)(H,45,50)(H4,37,38,41)/t25-,28+,29+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473825 (CHEMBL113765 | MEN-11983) Show SMILES O=C(N[C@H]1CCCCN(Cc2ccccc2)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)OCc1ccccc1 Show InChI InChI=1S/C41H43N5O5/c47-38-35(45-41(50)51-28-31-18-8-3-9-19-31)22-12-13-23-46(27-30-16-6-2-7-17-30)40(49)37(24-29-14-4-1-5-15-29)44-39(48)36(43-38)25-32-26-42-34-21-11-10-20-33(32)34/h1-11,14-21,26,35-37,42H,12-13,22-25,27-28H2,(H,43,47)(H,44,48)(H,45,50)/t35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473831 (CHEMBL432986 | MEN-11757) Show SMILES O[C@@H]1C[C@@](O)(C[C@@H](O)[C@H]1O)C(=O)N[C@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CNC1=O |wU:13.13,18.19,32.35,1.0,wD:3.3,8.9,43.47,6.6,(7.15,-23.4,;6.78,-21.91,;7.91,-20.86,;7.55,-19.37,;7.33,-18.05,;6.08,-18.91,;4.97,-19.96,;3.5,-19.52,;5.32,-21.46,;4.2,-22.52,;8.67,-18.3,;10.13,-18.75,;8.31,-16.82,;9.4,-15.79,;8.5,-14.67,;9.31,-13.21,;10.76,-13.56,;8.78,-11.69,;9.27,-10.23,;8.24,-9.08,;6.74,-9.39,;6.11,-10.8,;4.57,-10.64,;4.26,-9.13,;2.93,-8.36,;2.93,-6.83,;4.26,-6.05,;5.59,-6.82,;5.59,-8.36,;10.76,-9.9,;11.09,-11.32,;12.46,-8.43,;14.69,-8.48,;15.44,-6.85,;17.23,-6.71,;18.24,-8.18,;20.03,-8.04,;20.8,-6.41,;19.76,-4.94,;17.98,-5.1,;16.3,-10.1,;17.82,-9.78,;15.83,-11.57,;16.21,-13.58,;17.68,-14.06,;18,-15.56,;16.86,-16.58,;17.19,-18.07,;18.65,-18.55,;19.79,-17.51,;19.46,-16.02,;15.14,-14.6,;13.53,-14.81,;11.65,-16.05,;11.55,-17.37,)| Show InChI InChI=1S/C40H46N6O9/c47-32-19-40(55,20-33(48)35(32)50)39(54)46-31-18-34(49)44-30(17-25-21-41-28-14-8-7-13-27(25)28)38(53)45-29(16-24-11-5-2-6-12-24)37(52)43-26(22-42-36(31)51)15-23-9-3-1-4-10-23/h1-14,21,26,29-33,35,41,47-48,50,55H,15-20,22H2,(H,42,51)(H,43,52)(H,44,49)(H,45,53)(H,46,54)/t26-,29+,30+,31+,32-,33-,35-,40+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472912 (CHEMBL116564 | MEN-11712) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)CN1 Show InChI InChI=1S/C37H37N5O4/c43-34-16-17-35(44)41-33(21-28-22-38-31-13-7-6-12-30(28)31)37(46)42-32(20-24-8-2-1-3-9-24)36(45)40-29(23-39-34)19-25-14-15-26-10-4-5-11-27(26)18-25/h1-15,18,22,29,32-33,38H,16-17,19-21,23H2,(H,39,43)(H,40,45)(H,41,44)(H,42,46)/t29-,32+,33+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472912 (CHEMBL116564 | MEN-11712) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccc3ccccc3c2)CN1 Show InChI InChI=1S/C37H37N5O4/c43-34-16-17-35(44)41-33(21-28-22-38-31-13-7-6-12-30(28)31)37(46)42-32(20-24-8-2-1-3-9-24)36(45)40-29(23-39-34)19-25-14-15-26-10-4-5-11-27(26)18-25/h1-15,18,22,29,32-33,38H,16-17,19-21,23H2,(H,39,43)(H,40,45)(H,41,44)(H,42,46)/t29-,32+,33+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473837 (CHEMBL324532 | MEN-11877) Show SMILES NCCCC(=O)N[C@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CNC1=O Show InChI InChI=1S/C37H43N7O5/c38-17-9-16-33(45)42-32-21-34(46)43-31(20-26-22-39-29-15-8-7-14-28(26)29)37(49)44-30(19-25-12-5-2-6-13-25)36(48)41-27(23-40-35(32)47)18-24-10-3-1-4-11-24/h1-8,10-15,22,27,30-32,39H,9,16-21,23,38H2,(H,40,47)(H,41,48)(H,42,45)(H,43,46)(H,44,49)/t27-,30+,31+,32+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472908 (CHEMBL336053) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCc2ccccc2)CN1 Show InChI InChI=1S/C34H37N5O4/c40-31-17-18-32(41)38-30(20-25-21-35-28-14-8-7-13-27(25)28)34(43)39-29(19-24-11-5-2-6-12-24)33(42)37-26(22-36-31)16-15-23-9-3-1-4-10-23/h1-14,21,26,29-30,35H,15-20,22H2,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t26-,29+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472910 (CHEMBL263194) Show SMILES COc1ccc(CC2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1 Show InChI InChI=1S/C34H37N5O5/c1-44-26-13-11-23(12-14-26)17-25-21-36-31(40)15-16-32(41)38-30(19-24-20-35-28-10-6-5-9-27(24)28)34(43)39-29(33(42)37-25)18-22-7-3-2-4-8-22/h2-14,20,25,29-30,35H,15-19,21H2,1H3,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t25?,29-,30-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473838 (CHEMBL116629 | MEN-11708) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CC2=CC=CCC2)C(=O)N[C@H](CCc2ccccc2)CN1 |c:27,t:25| Show InChI InChI=1S/C34H39N5O4/c40-31-17-18-32(41)38-30(20-25-21-35-28-14-8-7-13-27(25)28)34(43)39-29(19-24-11-5-2-6-12-24)33(42)37-26(22-36-31)16-15-23-9-3-1-4-10-23/h1-5,7-11,13-14,21,26,29-30,35H,6,12,15-20,22H2,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t26-,29+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473827 (CHEMBL323836 | MEN-11668) Show SMILES COc1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](CC3=CC=CCC3)C(=O)N2)cc1 |c:37,t:35| Show InChI InChI=1S/C34H39N5O5/c1-44-26-13-11-23(12-14-26)17-25-21-36-31(40)15-16-32(41)38-30(19-24-20-35-28-10-6-5-9-27(24)28)34(43)39-29(33(42)37-25)18-22-7-3-2-4-8-22/h2-3,5-7,9-14,20,25,29-30,35H,4,8,15-19,21H2,1H3,(H,36,40)(H,37,42)(H,38,41)(H,39,43)/t25-,29+,30+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473832 (CHEMBL116969 | MEN-11755) Show SMILES OC(=O)CCC(=O)N[C@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CNC1=O Show InChI InChI=1S/C37H40N6O7/c44-32(15-16-34(46)47)41-31-20-33(45)42-30(19-25-21-38-28-14-8-7-13-27(25)28)37(50)43-29(18-24-11-5-2-6-12-24)36(49)40-26(22-39-35(31)48)17-23-9-3-1-4-10-23/h1-14,21,26,29-31,38H,15-20,22H2,(H,39,48)(H,40,49)(H,41,44)(H,42,45)(H,43,50)(H,46,47)/t26-,29+,30+,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472913 (CHEMBL2112675) Show SMILES FC(F)(F)c1ccc(C[C@@H]2CNC(=O)CCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)N2)cc1 Show InChI InChI=1S/C34H34F3N5O4/c35-34(36,37)24-12-10-22(11-13-24)16-25-20-39-30(43)14-15-31(44)41-29(18-23-19-38-27-9-5-4-8-26(23)27)33(46)42-28(32(45)40-25)17-21-6-2-1-3-7-21/h1-13,19,25,28-29,38H,14-18,20H2,(H,39,43)(H,40,45)(H,41,44)(H,42,46)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473834 (CHEMBL324106 | MEN-11733) Show SMILES O=C1CCCNC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-16-9-17-34-31(40)27(18-22-10-3-1-4-11-22)37-32(41)28(19-23-12-5-2-6-13-23)38-33(42)29(36-30)20-24-21-35-26-15-8-7-14-25(24)26/h1-8,10-15,21,27-29,35H,9,16-20H2,(H,34,40)(H,36,39)(H,37,41)(H,38,42)/t27-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473826 (CHEMBL116855 | MEN-11715) Show SMILES Clc1ccc(C[C@H]2NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)C[C@H](NC2=O)C(=O)OCC=C)cc1Cl Show InChI InChI=1S/C36H35Cl2N5O6/c1-2-14-49-36(48)31-19-32(44)40-30(18-23-20-39-27-11-7-6-10-24(23)27)35(47)41-28(16-21-8-4-3-5-9-21)33(45)42-29(34(46)43-31)17-22-12-13-25(37)26(38)15-22/h2-13,15,20,28-31,39H,1,14,16-19H2,(H,40,44)(H,41,47)(H,42,45)(H,43,46)/t28-,29+,30-,31-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472914 (CHEMBL114442 | MEN-11667) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CC2CCCCC2)CN1 Show InChI InChI=1S/C33H41N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h2,5-8,11-14,20,22,25,28-29,34H,1,3-4,9-10,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472914 (CHEMBL114442 | MEN-11667) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CC2CCCCC2)CN1 Show InChI InChI=1S/C33H41N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h2,5-8,11-14,20,22,25,28-29,34H,1,3-4,9-10,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473820 (CHEMBL117039 | MEN-11716) Show SMILES OC(=O)[C@@H]1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccc(Cl)c(Cl)c2)C(=O)N1 Show InChI InChI=1S/C33H31Cl2N5O6/c34-22-11-10-19(12-23(22)35)14-26-31(43)40-28(33(45)46)16-29(41)37-27(15-20-17-36-24-9-5-4-8-21(20)24)32(44)38-25(30(42)39-26)13-18-6-2-1-3-7-18/h1-12,17,25-28,36H,13-16H2,(H,37,41)(H,38,44)(H,39,42)(H,40,43)(H,45,46)/t25-,26+,27-,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473819 (CHEMBL326790 | MEN-11532) Show SMILES O=C1CC(CC2CC=CC=C2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCN1 |c:7,9| Show InChI InChI=1S/C33H37N5O4/c39-30-20-24(17-22-9-3-1-4-10-22)31(40)37-29(19-25-21-36-27-14-8-7-13-26(25)27)33(42)38-28(32(41)35-16-15-34-30)18-23-11-5-2-6-12-23/h1-9,11-14,21-22,24,28-29,36H,10,15-20H2,(H,34,39)(H,35,41)(H,37,40)(H,38,42)/t22?,24?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472919 (CHEMBL337628) Show SMILES O=C1CC(Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCN1 Show InChI InChI=1S/C33H35N5O4/c39-30-20-24(17-22-9-3-1-4-10-22)31(40)37-29(19-25-21-36-27-14-8-7-13-26(25)27)33(42)38-28(32(41)35-16-15-34-30)18-23-11-5-2-6-12-23/h1-14,21,24,28-29,36H,15-20H2,(H,34,39)(H,35,41)(H,37,40)(H,38,42)/t24?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472915 (CHEMBL114036 | MEN-11540) Show SMILES O=C1CC(Cc2ccccc2)C(=O)NCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-20-24(17-22-9-3-1-4-10-22)31(40)34-15-16-35-32(41)28(18-23-11-5-2-6-12-23)38-33(42)29(37-30)19-25-21-36-27-14-8-7-13-26(25)27/h1-14,21,24,28-29,36H,15-20H2,(H,34,40)(H,35,41)(H,37,39)(H,38,42)/t24?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472915 (CHEMBL114036 | MEN-11540) Show SMILES O=C1CC(Cc2ccccc2)C(=O)NCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-20-24(17-22-9-3-1-4-10-22)31(40)34-15-16-35-32(41)28(18-23-11-5-2-6-12-23)38-33(42)29(37-30)19-25-21-36-27-14-8-7-13-26(25)27/h1-14,21,24,28-29,36H,15-20H2,(H,34,40)(H,35,41)(H,37,39)(H,38,42)/t24?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472918 (CHEMBL324804 | MEN-11970) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCN1 Show InChI InChI=1S/C26H29N5O4/c32-23-10-11-24(33)30-22(15-18-16-29-20-9-5-4-8-19(18)20)26(35)31-21(25(34)28-13-12-27-23)14-17-6-2-1-3-7-17/h1-9,16,21-22,29H,10-15H2,(H,27,32)(H,28,34)(H,30,33)(H,31,35)/t21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472907 (CHEMBL131024) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NC(Cc2ccccc2)CN1 Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25?,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472918 (CHEMBL324804 | MEN-11970) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCCN1 Show InChI InChI=1S/C26H29N5O4/c32-23-10-11-24(33)30-22(15-18-16-29-20-9-5-4-8-19(18)20)26(35)31-21(25(34)28-13-12-27-23)14-17-6-2-1-3-7-17/h1-9,16,21-22,29H,10-15H2,(H,27,32)(H,28,34)(H,30,33)(H,31,35)/t21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472909 (CHEMBL2112669) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NC[C@@H](Cc2ccccc2)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)35-21-25(36-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,41)(H,36,39)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472906 (CHEMBL2111858) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)NC[C@H](Cc2ccccc2)N1 Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)35-21-25(36-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,41)(H,36,39)(H,37,40)(H,38,42)/t25-,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Binding affinity towards Tachykinin receptor 2				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50473835 (CHEMBL420685 | MEN-11523) Show SMILES NC(=O)[C@@H]1CNC(=O)CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1 Show InChI InChI=1S/C27H30N6O5/c28-25(36)22-15-30-23(34)10-11-24(35)31-21(13-17-14-29-19-9-5-4-8-18(17)19)27(38)32-20(26(37)33-22)12-16-6-2-1-3-7-16/h1-9,14,20-22,29H,10-13,15H2,(H2,28,36)(H,30,34)(H,31,35)(H,32,38)(H,33,37)/t20-,21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Inhibitory affinity constant (pKi) against tachykinin receptor 2 (NK-2R) using heterologous competition experiments				J Med Chem 45: 3418-29 (2002) Article DOI: 10.1021/jm011127h BindingDB Entry DOI: 10.7270/Q2765J28
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472911 (CHEMBL407782 | MEN-11420) Show SMILES [H][C@]12CNC(=O)C[C@]([H])(NC(=O)[C@H](CC(=O)N[C@@H]3O[C@H](CO)[C@@H](O)[C@H](CO)[C@H]3NC(C)=O)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C46H60N10O13/c1-22(2)13-29-40(63)54-33(17-37(61)56-46-38(49-23(3)59)27(20-57)39(62)35(21-58)69-46)44(67)53-32-16-36(60)48-19-34(45(68)50-29)55-41(64)30(14-24-9-5-4-6-10-24)51-42(65)31(52-43(32)66)15-25-18-47-28-12-8-7-11-26(25)28/h4-12,18,22,27,29-35,38-39,46-47,57-58,62H,13-17,19-21H2,1-3H3,(H,48,60)(H,49,59)(H,50,68)(H,51,65)(H,52,66)(H,53,67)(H,54,63)(H,55,64)(H,56,61)/t27-,29+,30+,31+,32+,33+,34+,35-,38-,39+,46-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for Kd value against [3H]-SR- 48968 on the Tyr206Phe mutated human NK-2 receptor				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472911 (CHEMBL407782 | MEN-11420) Show SMILES [H][C@]12CNC(=O)C[C@]([H])(NC(=O)[C@H](CC(=O)N[C@@H]3O[C@H](CO)[C@@H](O)[C@H](CO)[C@H]3NC(C)=O)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C46H60N10O13/c1-22(2)13-29-40(63)54-33(17-37(61)56-46-38(49-23(3)59)27(20-57)39(62)35(21-58)69-46)44(67)53-32-16-36(60)48-19-34(45(68)50-29)55-41(64)30(14-24-9-5-4-6-10-24)51-42(65)31(52-43(32)66)15-25-18-47-28-12-8-7-11-26(25)28/h4-12,18,22,27,29-35,38-39,46-47,57-58,62H,13-17,19-21H2,1-3H3,(H,48,60)(H,49,59)(H,50,68)(H,51,65)(H,52,66)(H,53,67)(H,54,63)(H,55,64)(H,56,61)/t27-,29+,30+,31+,32+,33+,34+,35-,38-,39+,46-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for Kd value against [125I]NKA on the Tyr266Phe mutated human NK-2 receptor				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50404020 (CHEMBL435324 | MEN-11558) Show SMILES O=C1CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)CN1 |r| Show InChI InChI=1S/C33H35N5O4/c39-30-15-16-31(40)37-29(19-24-20-34-27-14-8-7-13-26(24)27)33(42)38-28(18-23-11-5-2-6-12-23)32(41)36-25(21-35-30)17-22-9-3-1-4-10-22/h1-14,20,25,28-29,34H,15-19,21H2,(H,35,39)(H,36,41)(H,37,40)(H,38,42)/t25-,28+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for Kd value against [125I]NKA on the Tyr266Phe mutated human NK-2 receptor				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472911 (CHEMBL407782 | MEN-11420) Show SMILES [H][C@]12CNC(=O)C[C@]([H])(NC(=O)[C@H](CC(=O)N[C@@H]3O[C@H](CO)[C@@H](O)[C@H](CO)[C@H]3NC(C)=O)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C46H60N10O13/c1-22(2)13-29-40(63)54-33(17-37(61)56-46-38(49-23(3)59)27(20-57)39(62)35(21-58)69-46)44(67)53-32-16-36(60)48-19-34(45(68)50-29)55-41(64)30(14-24-9-5-4-6-10-24)51-42(65)31(52-43(32)66)15-25-18-47-28-12-8-7-11-26(25)28/h4-12,18,22,27,29-35,38-39,46-47,57-58,62H,13-17,19-21H2,1-3H3,(H,48,60)(H,49,59)(H,50,68)(H,51,65)(H,52,66)(H,53,67)(H,54,63)(H,55,64)(H,56,61)/t27-,29+,30+,31+,32+,33+,34+,35-,38-,39+,46-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	291	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for Kd value against [3H]-SR- 48968 on the Phe270Ala mutated human NK-2 receptor				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair
Substance-K receptor (Homo sapiens (Human))	BDBM50472911 (CHEMBL407782 | MEN-11420) Show SMILES [H][C@]12CNC(=O)C[C@]([H])(NC(=O)[C@H](CC(=O)N[C@@H]3O[C@H](CO)[C@@H](O)[C@H](CO)[C@H]3NC(C)=O)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](Cc1ccccc1)C(=O)N2 Show InChI InChI=1S/C46H60N10O13/c1-22(2)13-29-40(63)54-33(17-37(61)56-46-38(49-23(3)59)27(20-57)39(62)35(21-58)69-46)44(67)53-32-16-36(60)48-19-34(45(68)50-29)55-41(64)30(14-24-9-5-4-6-10-24)51-42(65)31(52-43(32)66)15-25-18-47-28-12-8-7-11-26(25)28/h4-12,18,22,27,29-35,38-39,46-47,57-58,62H,13-17,19-21H2,1-3H3,(H,48,60)(H,49,59)(H,50,68)(H,51,65)(H,52,66)(H,53,67)(H,54,63)(H,55,64)(H,56,61)/t27-,29+,30+,31+,32+,33+,34+,35-,38-,39+,46-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche S.p.A. Curated by ChEMBL					Assay Description Compound was evaluated for Kd value against [3H]-SR- 48968 on the Tyr266Phe mutated human NK-2 receptor				J Med Chem 43: 4041-4 (2000) Article DOI: 10.1021/jm0010217 BindingDB Entry DOI: 10.7270/Q2Z322CV
					More data for this Ligand-Target Pair

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