Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuromedin-U receptor 2' and Ligand = 'BDBM50238709'   

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
Neuromedin-U receptor 2 (Homo sapiens (Human))	BDBM50238709 (CHEMBL4092033) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN1CCNCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O |r| Show InChI InChI=1S/C55H86N18O13/c1-31(2)26-40(70-49(82)37(18-19-45(77)78)67-51(84)41(28-34-14-16-35(74)17-15-34)65-44(76)30-73-24-22-62-23-25-73)50(83)71-42(27-33-10-6-5-7-11-33)52(85)68-38(13-9-21-64-55(60)61)53(86)72(4)32(3)47(80)66-36(12-8-20-63-54(58)59)48(81)69-39(46(57)79)29-43(56)75/h5-7,10-11,14-17,31-32,36-42,62,74H,8-9,12-13,18-30H2,1-4H3,(H2,56,75)(H2,57,79)(H,65,76)(H,66,80)(H,67,84)(H,68,85)(H,69,81)(H,70,82)(H,71,83)(H,77,78)(H4,58,59,63)(H4,60,61,64)/t32-,36-,37-,38-,39-,40-,41-,42-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.930	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd. Curated by ChEMBL					Assay Description Agonist activity at human NMUR2 expressed in CHO cells assessed as induction of Ca2+ flux measured for 180 secs by Fluo 4-AM dye-based FLIPR assay				J Med Chem 60: 6089-6097 (2017) Article DOI: 10.1021/acs.jmedchem.7b00330 BindingDB Entry DOI: 10.7270/Q2W37ZKK
					More data for this Ligand-Target Pair
Neuromedin-U receptor 2 (Mus musculus)	BDBM50238709 (CHEMBL4092033) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN1CCNCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O |r| Show InChI InChI=1S/C55H86N18O13/c1-31(2)26-40(70-49(82)37(18-19-45(77)78)67-51(84)41(28-34-14-16-35(74)17-15-34)65-44(76)30-73-24-22-62-23-25-73)50(83)71-42(27-33-10-6-5-7-11-33)52(85)68-38(13-9-21-64-55(60)61)53(86)72(4)32(3)47(80)66-36(12-8-20-63-54(58)59)48(81)69-39(46(57)79)29-43(56)75/h5-7,10-11,14-17,31-32,36-42,62,74H,8-9,12-13,18-30H2,1-4H3,(H2,56,75)(H2,57,79)(H,65,76)(H,66,80)(H,67,84)(H,68,85)(H,69,81)(H,70,82)(H,71,83)(H,77,78)(H4,58,59,63)(H4,60,61,64)/t32-,36-,37-,38-,39-,40-,41-,42-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.40	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd. Curated by ChEMBL					Assay Description Agonist activity at mouse NMUR2 expressed in CHO cells assessed as induction of Ca2+ flux measured for 180 secs by Fluo 4-AM dye-based FLIPR assay				J Med Chem 60: 6089-6097 (2017) Article DOI: 10.1021/acs.jmedchem.7b00330 BindingDB Entry DOI: 10.7270/Q2W37ZKK
					More data for this Ligand-Target Pair