Found 2 hits for monomerid = 50084105 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50084105
(CHEMBL3425817)Show SMILES O[C@@]1(CC23CCC(CC2)(CO3)NCc2cc3c(OCCS3(=O)=O)cn2)Cn2c3c1c(F)cnc3ccc2=O |r,wD:1.0,(2.15,2.32,;.93,2.51,;.33,3.93,;-1.21,4.14,;-1.59,2.68,;-3.13,2.5,;-4.07,3.76,;-2.64,3.2,;-2.42,4.73,;-3.45,5.16,;-1.92,5.36,;-5.58,3.52,;-6.14,2.07,;-7.67,1.83,;-8.24,.38,;-9.77,.14,;-10.74,1.35,;-12.27,1.11,;-12.83,-.33,;-11.86,-1.54,;-10.33,-1.3,;-9.11,-1.08,;-10.81,-2.45,;-10.18,2.79,;-8.64,3.04,;-1,2.53,;-1.3,1,;,.25,;1.32,1,;2.64,.25,;3.72,.87,;2.64,-1.26,;1.32,-2.02,;,-1.26,;-1.3,-2.02,;-2.62,-1.26,;-2.62,.25,;-3.7,.87,)| Show InChI InChI=1S/C26H27FN4O6S/c27-17-11-29-18-1-2-21(32)31-14-26(33,22(17)23(18)31)13-25-5-3-24(4-6-25,15-37-25)30-10-16-9-20-19(12-28-16)36-7-8-38(20,34)35/h1-2,9,11-12,30,33H,3-8,10,13-15H2/t24?,25?,26-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >6.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of MK499 from human ERG |
Bioorg Med Chem Lett 25: 2473-8 (2015)
Article DOI: 10.1016/j.bmcl.2015.04.063
BindingDB Entry DOI: 10.7270/Q2NZ89BD |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50084105
(CHEMBL3425817)Show SMILES O[C@@]1(CC23CCC(CC2)(CO3)NCc2cc3c(OCCS3(=O)=O)cn2)Cn2c3c1c(F)cnc3ccc2=O |r,wD:1.0,(2.15,2.32,;.93,2.51,;.33,3.93,;-1.21,4.14,;-1.59,2.68,;-3.13,2.5,;-4.07,3.76,;-2.64,3.2,;-2.42,4.73,;-3.45,5.16,;-1.92,5.36,;-5.58,3.52,;-6.14,2.07,;-7.67,1.83,;-8.24,.38,;-9.77,.14,;-10.74,1.35,;-12.27,1.11,;-12.83,-.33,;-11.86,-1.54,;-10.33,-1.3,;-9.11,-1.08,;-10.81,-2.45,;-10.18,2.79,;-8.64,3.04,;-1,2.53,;-1.3,1,;,.25,;1.32,1,;2.64,.25,;3.72,.87,;2.64,-1.26,;1.32,-2.02,;,-1.26,;-1.3,-2.02,;-2.62,-1.26,;-2.62,.25,;-3.7,.87,)| Show InChI InChI=1S/C26H27FN4O6S/c27-17-11-29-18-1-2-21(32)31-14-26(33,22(17)23(18)31)13-25-5-3-24(4-6-25,15-37-25)30-10-16-9-20-19(12-28-16)36-7-8-38(20,34)35/h1-2,9,11-12,30,33H,3-8,10,13-15H2/t24?,25?,26-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >6.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of human ERG expressed in CHO cells measured over 5 mins by patch clamp assay |
Bioorg Med Chem Lett 25: 2473-8 (2015)
Article DOI: 10.1016/j.bmcl.2015.04.063
BindingDB Entry DOI: 10.7270/Q2NZ89BD |
More data for this
Ligand-Target Pair | |
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