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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 272556   
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
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM272556
PNG
(US10065967, Example 22 | US9745307, Example 22)
Show SMILES Cc1cc(ccn1)-c1n[nH]c2cc3NC(=O)N(Cc3cc12)[C@@H]1CCCCc2ccccc12
Show InChI InChI=1S/C26H25N5O/c1-16-12-18(10-11-27-16)25-21-13-19-15-31(26(32)28-22(19)14-23(21)29-30-25)24-9-5-3-7-17-6-2-4-8-20(17)24/h2,4,6,8,10-14,24H,3,5,7,9,15H2,1H3,(H,28,32)(H,29,30)/t24-/m1/s1
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 24n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Activated ERK2 activity was determined in an IMAP-FP assay (Molecular Devices). Using this assay format, the potency (IC50) of each compound was dete...


US Patent US9745307 (2017)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM272556
PNG
(US10065967, Example 22 | US9745307, Example 22)
Show SMILES Cc1cc(ccn1)-c1n[nH]c2cc3NC(=O)N(Cc3cc12)[C@@H]1CCCCc2ccccc12
Show InChI InChI=1S/C26H25N5O/c1-16-12-18(10-11-27-16)25-21-13-19-15-31(26(32)28-22(19)14-23(21)29-30-25)24-9-5-3-7-17-6-2-4-8-20(17)24/h2,4,6,8,10-14,24H,3,5,7,9,15H2,1H3,(H,28,32)(H,29,30)/t24-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 24n/an/an/an/an/an/a



Merck, Sharp & Dohme Corp.

US Patent


Assay Description
Activated ERK2 activity was determined in an IMAP-FP assay (Molecular Devices). Using this assay format, the potency (IC50) of each compound was dete...


US Patent US10065967 (2018)

More data for this
Ligand-Target Pair