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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50291676   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Neuromedin-U receptor 1


(Homo sapiens (Human))
BDBM50291676
PNG
(CHEMBL4176206)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N(CCc1ccccc1)CC(=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/C55H80N16O10/c1-33(2)28-43(69-50(78)42(30-35-14-7-4-8-15-35)68-48(76)38(56)29-36-19-21-37(72)22-20-36)52(80)70(27-23-34-12-5-3-6-13-34)32-46(74)65-40(17-10-25-64-55(61)62)53(81)71-26-11-18-44(71)51(79)66-39(16-9-24-63-54(59)60)49(77)67-41(47(58)75)31-45(57)73/h3-8,12-15,19-22,33,38-44,72H,9-11,16-18,23-32,56H2,1-2H3,(H2,57,73)(H2,58,75)(H,65,74)(H,66,79)(H,67,77)(H,68,76)(H,69,78)(H4,59,60,63)(H4,61,62,64)/t38-,39-,40-,41-,42-,43-,44-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]-NMU-8 from human NMUR1 expressed in HEK293 cell membranes after 3 hrs by microscintillation counting


Eur J Med Chem 144: 887-897 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.035
BindingDB Entry DOI: 10.7270/Q22B91JP
More data for this
Ligand-Target Pair
Neuromedin-U receptor 2


(Homo sapiens (Human))
BDBM50291676
PNG
(CHEMBL4176206)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N(CCc1ccccc1)CC(=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/C55H80N16O10/c1-33(2)28-43(69-50(78)42(30-35-14-7-4-8-15-35)68-48(76)38(56)29-36-19-21-37(72)22-20-36)52(80)70(27-23-34-12-5-3-6-13-34)32-46(74)65-40(17-10-25-64-55(61)62)53(81)71-26-11-18-44(71)51(79)66-39(16-9-24-63-54(59)60)49(77)67-41(47(58)75)31-45(57)73/h3-8,12-15,19-22,33,38-44,72H,9-11,16-18,23-32,56H2,1-2H3,(H2,57,73)(H2,58,75)(H,65,74)(H,66,79)(H,67,77)(H,68,76)(H,69,78)(H4,59,60,63)(H4,61,62,64)/t38-,39-,40-,41-,42-,43-,44-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 262n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]-NMU-8 from human NMUR2 expressed in HEK293 cell membranes after 3 hrs by microscintillation counting


Eur J Med Chem 144: 887-897 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.035
BindingDB Entry DOI: 10.7270/Q22B91JP
More data for this
Ligand-Target Pair