Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuromedin-U receptor 1' and Ligand = 'BDBM50238688' 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 1
(Mus musculus) | BDBM50238688
![PNG](/data/jpeg/tenK5023/BindingDB_50238688.png) (CHEMBL4082455)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O |r| Show InChI InChI=1S/C53H83N17O11/c1-30(2)26-39(68-46(76)35(14-7-8-22-54)64-48(78)40(63-31(3)71)28-33-18-20-34(72)21-19-33)47(77)69-41(27-32-12-5-4-6-13-32)49(79)66-37(16-10-24-62-53(59)60)51(81)70-25-11-17-42(70)50(80)65-36(15-9-23-61-52(57)58)45(75)67-38(44(56)74)29-43(55)73/h4-6,12-13,18-21,30,35-42,72H,7-11,14-17,22-29,54H2,1-3H3,(H2,55,73)(H2,56,74)(H,63,71)(H,64,78)(H,65,80)(H,66,79)(H,67,75)(H,68,76)(H,69,77)(H4,57,58,61)(H4,59,60,62)/t35-,36-,37-,38-,39-,40-,41-,42-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 83 | n/a | n/a | n/a | n/a |
Takeda Pharmaceutical Company, Ltd.
Curated by ChEMBL
| Assay Description Agonist activity at mouse NMUR1 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 1
(Homo sapiens (Human)) | BDBM50238688
![PNG](/data/jpeg/tenK5023/BindingDB_50238688.png) (CHEMBL4082455)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O |r| Show InChI InChI=1S/C53H83N17O11/c1-30(2)26-39(68-46(76)35(14-7-8-22-54)64-48(78)40(63-31(3)71)28-33-18-20-34(72)21-19-33)47(77)69-41(27-32-12-5-4-6-13-32)49(79)66-37(16-10-24-62-53(59)60)51(81)70-25-11-17-42(70)50(80)65-36(15-9-23-61-52(57)58)45(75)67-38(44(56)74)29-43(55)73/h4-6,12-13,18-21,30,35-42,72H,7-11,14-17,22-29,54H2,1-3H3,(H2,55,73)(H2,56,74)(H,63,71)(H,64,78)(H,65,80)(H,66,79)(H,67,75)(H,68,76)(H,69,77)(H4,57,58,61)(H4,59,60,62)/t35-,36-,37-,38-,39-,40-,41-,42-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a |
Takeda Pharmaceutical Company, Ltd.
Curated by ChEMBL
| Assay Description Agonist activity at human NMUR1 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 | |