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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50263878   
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
Atypical chemokine receptor 3


(Homo sapiens (Human))
BDBM50263878
PNG
(CHEMBL4085246)
Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r|
Show InChI InChI=1S/C43H50N8O6/c1-50-36(13-7-21-46-43(44)45)39(54)49-35(26-29-15-18-30-11-5-6-12-31(30)23-29)42(57)51-22-8-14-37(51)40(55)47-33(24-28-16-19-32(52)20-17-28)38(53)48-34(41(50)56)25-27-9-3-2-4-10-27/h2-6,9-12,15-20,23,33-37,52H,7-8,13-14,21-22,24-26H2,1H3,(H,47,55)(H,48,53)(H,49,54)(H4,44,45,46)/t33-,34+,35+,36+,37+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from ACKR3 (unknown origin) expressed in CHO cells after 1 hr by scintillation counting method


J Med Chem 61: 3745-3751 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00336
BindingDB Entry DOI: 10.7270/Q23B62M5
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 4


(Homo sapiens (Human))
BDBM50263878
PNG
(CHEMBL4085246)
Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1ccc3ccccc3c1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC2=O |r|
Show InChI InChI=1S/C43H50N8O6/c1-50-36(13-7-21-46-43(44)45)39(54)49-35(26-29-15-18-30-11-5-6-12-31(30)23-29)42(57)51-22-8-14-37(51)40(55)47-33(24-28-16-19-32(52)20-17-28)38(53)48-34(41(50)56)25-27-9-3-2-4-10-27/h2-6,9-12,15-20,23,33-37,52H,7-8,13-14,21-22,24-26H2,1H3,(H,47,55)(H,48,53)(H,49,54)(H4,44,45,46)/t33-,34+,35+,36+,37+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR4 (unknown origin) expressed in HEK293 cells after 1 hr by scintillation counting method


J Med Chem 61: 3745-3751 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00336
BindingDB Entry DOI: 10.7270/Q23B62M5
More data for this
Ligand-Target Pair