BindingDB logo
myBDB logout

BDBM50153103 CHEMBL3775500

SMILES: O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCCCC2)cn1

InChI Key: InChIKey=SSZGYIZGRDDQEH-UHFFFAOYSA-N

Data: 4 IC50

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 4 hits for monomerid = 50153103   
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
Lysine-specific demethylase 5B (KDM5Flag-5B-FL)


(Homo sapiens (Human))
BDBM50153103
PNG
(CHEMBL3775500)
Show SMILES O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCCCC2)cn1
Show InChI InChI=1S/C17H20N6O/c24-17-14-4-6-18-16(15(14)19-12-20-17)23-11-13(10-21-23)5-9-22-7-2-1-3-8-22/h4,6,10-12H,1-3,5,7-9H2,(H,19,20,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 199n/an/an/an/an/an/a



The Institute of Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of KDM5B (unknown origin) using biotin-H3K4me3 as substrate preincubated for 15 mins followed by substrate addition measured after 20 mins...


Citation and Details
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5C


(Homo sapiens)
BDBM50153103
PNG
(CHEMBL3775500)
Show SMILES O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCCCC2)cn1
Show InChI InChI=1S/C17H20N6O/c24-17-14-4-6-18-16(15(14)19-12-20-17)23-11-13(10-21-23)5-9-22-7-2-1-3-8-22/h4,6,10-12H,1-3,5,7-9H2,(H,19,20,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 342n/an/an/an/an/an/a



The Institute of Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of KDM5C (unknown origin) using biotin-H3K4me3 as substrate preincubated for 15 mins followed by substrate addition measured after 20 mins...


Citation and Details
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4A


(Homo sapiens (Human))
BDBM50153103
PNG
(CHEMBL3775500)
Show SMILES O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCCCC2)cn1
Show InChI InChI=1S/C17H20N6O/c24-17-14-4-6-18-16(15(14)19-12-20-17)23-11-13(10-21-23)5-9-22-7-2-1-3-8-22/h4,6,10-12H,1-3,5,7-9H2,(H,19,20,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



The Institute of Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged KDM4A (1 to 359 residues) expressed in Escherichia coli using biotin-H3K9me3 as substrate preincubated for ...


Citation and Details
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4B


(Homo sapiens)
BDBM50153103
PNG
(CHEMBL3775500)
Show SMILES O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCCCC2)cn1
Show InChI InChI=1S/C17H20N6O/c24-17-14-4-6-18-16(15(14)19-12-20-17)23-11-13(10-21-23)5-9-22-7-2-1-3-8-22/h4,6,10-12H,1-3,5,7-9H2,(H,19,20,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 650n/an/an/an/an/an/a



The Institute of Cancer Research

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal GST-tagged KDM4B (1 to 500 residues) expressed in baculovirus infected sf9 cells using biotin-H3K9me3 as s...


Citation and Details
More data for this
Ligand-Target Pair