BindingDB logo
myBDB logout

BDBM303920 US10138242, Compound 6

SMILES: O=C(NCc1ccccc1)c1nn(c2CCN(Cc3c[nH]c4ccccc34)Cc12)-c1ccccc1

InChI Key: InChIKey=UWGABZHMEAADOQ-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 303920   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
PEX14-PEX5


(Homo sapiens (Human))
BDBM303920
PNG
(US10138242, Compound 6)
Show SMILES O=C(NCc1ccccc1)c1nn(c2CCN(Cc3c[nH]c4ccccc34)Cc12)-c1ccccc1
Show InChI InChI=1S/C29H27N5O/c35-29(31-17-21-9-3-1-4-10-21)28-25-20-33(19-22-18-30-26-14-8-7-13-24(22)26)16-15-27(25)34(32-28)23-11-5-2-6-12-23/h1-14,18,30H,15-17,19-20H2,(H,31,35)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.27E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Antitrypanosomal activity was tested on T. brucei brucei bloodstream from parasites (strainżLister 427, VATMITat 1.2). Stock solutions of compounds (...


US Patent US10138242 (2018)

More data for this
Ligand-Target Pair
PEX14-PEX5


(Homo sapiens (Human))
BDBM303920
PNG
(US10138242, Compound 6)
Show SMILES O=C(NCc1ccccc1)c1nn(c2CCN(Cc3c[nH]c4ccccc34)Cc12)-c1ccccc1
Show InChI InChI=1S/C29H27N5O/c35-29(31-17-21-9-3-1-4-10-21)28-25-20-33(19-22-18-30-26-14-8-7-13-24(22)26)16-15-27(25)34(32-28)23-11-5-2-6-12-23/h1-14,18,30H,15-17,19-20H2,(H,31,35)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.83E+4n/an/an/an/a



TBA

US Patent


Assay Description
The assay uses two types of beads: donor beads are coupled with streptavidin, and acceptor beads are coupled with an anti His-tag antibody. Upon exci...


US Patent US10138242 (2018)

More data for this
Ligand-Target Pair