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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Chemerin-like receptor 1' and Ligand = 'BDBM50517133'   
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
Chemerin-like receptor 1


(Homo sapiens (Human))
BDBM50517133
PNG
(CHEMBL4448632)
Show SMILES CCCCN([C@H](C)c1ccc(cc1)-c1ccccc1-c1nnn[nH]1)c1nc2cc(ccc2o1)C(=O)NC |r|
Show InChI InChI=1S/C28H29N7O2/c1-4-5-16-35(28-30-24-17-21(27(36)29-3)14-15-25(24)37-28)18(2)19-10-12-20(13-11-19)22-8-6-7-9-23(22)26-31-33-34-32-26/h6-15,17-18H,4-5,16H2,1-3H3,(H,29,36)(H,31,32,33,34)/t18-/m1/s1
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PC sid
UniChem
Article
PubMed
n/an/a 38n/an/an/an/an/an/a



Kyowa Kirin Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of chemR23 in human CAL1 cells assessed as reduction in chemerin-induced intracellular calcium ion concentration preincubated for 45 mins ...


Bioorg Med Chem 27: (2019)


Article DOI: 10.1016/j.bmc.2019.115091
BindingDB Entry DOI: 10.7270/Q2N30190
More data for this
Ligand-Target Pair
Chemerin-like receptor 1


(Mus musculus)
BDBM50517133
PNG
(CHEMBL4448632)
Show SMILES CCCCN([C@H](C)c1ccc(cc1)-c1ccccc1-c1nnn[nH]1)c1nc2cc(ccc2o1)C(=O)NC |r|
Show InChI InChI=1S/C28H29N7O2/c1-4-5-16-35(28-30-24-17-21(27(36)29-3)14-15-25(24)37-28)18(2)19-10-12-20(13-11-19)22-8-6-7-9-23(22)26-31-33-34-32-26/h6-15,17-18H,4-5,16H2,1-3H3,(H,29,36)(H,31,32,33,34)/t18-/m1/s1
UniProtKB/SwissProt

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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Kyowa Kirin Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of chemR23 expressed in mouse BA/F3 cells assessed as reduction in chemerin-induced intracellular calcium ion concentration preincubated f...


Bioorg Med Chem 27: (2019)


Article DOI: 10.1016/j.bmc.2019.115091
BindingDB Entry DOI: 10.7270/Q2N30190
More data for this
Ligand-Target Pair
Chemerin-like receptor 1


(Homo sapiens (Human))
BDBM50517133
PNG
(CHEMBL4448632)
Show SMILES CCCCN([C@H](C)c1ccc(cc1)-c1ccccc1-c1nnn[nH]1)c1nc2cc(ccc2o1)C(=O)NC |r|
Show InChI InChI=1S/C28H29N7O2/c1-4-5-16-35(28-30-24-17-21(27(36)29-3)14-15-25(24)37-28)18(2)19-10-12-20(13-11-19)22-8-6-7-9-23(22)26-31-33-34-32-26/h6-15,17-18H,4-5,16H2,1-3H3,(H,29,36)(H,31,32,33,34)/t18-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 380n/an/an/an/an/an/a



Kyowa Kirin Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of chemR23 expressed in human CAL1 cells assessed as reduction in chemerin-induced chemotaxis incubated for 4 hrs by cell counting based C...


Bioorg Med Chem 27: (2019)


Article DOI: 10.1016/j.bmc.2019.115091
BindingDB Entry DOI: 10.7270/Q2N30190
More data for this
Ligand-Target Pair
Chemerin-like receptor 1


(Homo sapiens (Human))
BDBM50517133
PNG
(CHEMBL4448632)
Show SMILES CCCCN([C@H](C)c1ccc(cc1)-c1ccccc1-c1nnn[nH]1)c1nc2cc(ccc2o1)C(=O)NC |r|
Show InChI InChI=1S/C28H29N7O2/c1-4-5-16-35(28-30-24-17-21(27(36)29-3)14-15-25(24)37-28)18(2)19-10-12-20(13-11-19)22-8-6-7-9-23(22)26-31-33-34-32-26/h6-15,17-18H,4-5,16H2,1-3H3,(H,29,36)(H,31,32,33,34)/t18-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 280n/an/an/an/a



Kyowa Kirin Co., Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at chemR23 expressed in human CAL1 cells assessed as increase in intracellular calcium ion concentration


Bioorg Med Chem 27: (2019)


Article DOI: 10.1016/j.bmc.2019.115091
BindingDB Entry DOI: 10.7270/Q2N30190
More data for this
Ligand-Target Pair