Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuropeptide Y receptor type 4' and Ligand = 'BDBM50511368'   

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
Neuropeptide Y receptor type 4 (Homo sapiens (Human))	BDBM50511368 (CHEMBL4468313) Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(=N)NC(=O)NCCCCC#C)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r| Show InChI InChI=1S/C51H79N17O10.3C2HF3O2/c1-5-6-7-8-23-61-51(78)68-50(57)60-26-11-12-36(62-31(4)69)43(73)63-38(14-10-25-59-49(55)56)45(75)67-41(29-33-17-21-35(71)22-18-33)47(77)66-40(27-30(2)3)46(76)64-37(13-9-24-58-48(53)54)44(74)65-39(42(52)72)28-32-15-19-34(70)20-16-32;3*3-2(4,5)1(6)7/h1,15-22,30,36-41,70-71H,6-14,23-29H2,2-4H3,(H2,52,72)(H,62,69)(H,63,73)(H,64,76)(H,65,74)(H,66,77)(H,67,75)(H4,53,54,58)(H4,55,56,59)(H4,57,60,61,68,78);3*(H,6,7)/t36-,37-,38-,39-,40-,41-;;;/m0.../s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Displacement of [3H]UR-KK200 from human Y4R expressed in CHO cells incubated for 90 mins by microbeta scintillation counting method				ACS Med Chem Lett 11: 334-339 (2020) Article DOI: 10.1021/acsmedchemlett.9b00388 BindingDB Entry DOI: 10.7270/Q2348PQN
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 4 (Homo sapiens (Human))	BDBM50511368 (CHEMBL4468313) Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(=N)NC(=O)NCCCCC#C)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r| Show InChI InChI=1S/C51H79N17O10.3C2HF3O2/c1-5-6-7-8-23-61-51(78)68-50(57)60-26-11-12-36(62-31(4)69)43(73)63-38(14-10-25-59-49(55)56)45(75)67-41(29-33-17-21-35(71)22-18-33)47(77)66-40(27-30(2)3)46(76)64-37(13-9-24-58-48(53)54)44(74)65-39(42(52)72)28-32-15-19-34(70)20-16-32;3*3-2(4,5)1(6)7/h1,15-22,30,36-41,70-71H,6-14,23-29H2,2-4H3,(H2,52,72)(H,62,69)(H,63,73)(H,64,76)(H,65,74)(H,66,77)(H,67,75)(H4,53,54,58)(H4,55,56,59)(H4,57,60,61,68,78);3*(H,6,7)/t36-,37-,38-,39-,40-,41-;;;/m0.../s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Displacement of [3H]UR-KK200 from human Y4R expressed in CHO cells incubated for 90 mins by microbeta scintillation counting method				ACS Med Chem Lett 11: 334-339 (2020) Article DOI: 10.1021/acsmedchemlett.9b00388 BindingDB Entry DOI: 10.7270/Q2348PQN
					More data for this Ligand-Target Pair