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SMILES: CN(C)C1CN(CCC1Nc1nn(C)c(=O)c2cccnc12)c1ccc(Cl)cc1

InChI Key: InChIKey=UGPZFEUGECMRRH-UHFFFAOYSA-N

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 3 hits for monomerid = 311444   
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
Histone acetyltransferase KAT2B [719-832]


(Homo sapiens (Human))
BDBM311444
PNG
(CHEM-US-00141 | US10155764, Example 32 | US1015576...)
Show SMILES CN(C)C1CN(CCC1Nc1nn(C)c(=O)c2cccnc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H25ClN6O/c1-26(2)18-13-28(15-8-6-14(22)7-9-15)12-10-17(18)24-20-19-16(5-4-11-23-19)21(29)27(3)25-20/h4-9,11,17-18H,10,12-13H2,1-3H3,(H,24,25)
PDB
MMDB

NCI pathway
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UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 140n/an/an/an/an/an/a



GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC.

US Patent


Assay Description
His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...


US Patent US10155764 (2018)


BindingDB Entry DOI: 10.7270/Q25M67T9
More data for this
Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832]


(Homo sapiens (Human))
BDBM311444
PNG
(CHEM-US-00141 | US10155764, Example 32 | US1015576...)
Show SMILES CN(C)C1CN(CCC1Nc1nn(C)c(=O)c2cccnc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H25ClN6O/c1-26(2)18-13-28(15-8-6-14(22)7-9-15)12-10-17(18)24-20-19-16(5-4-11-23-19)21(29)27(3)25-20/h4-9,11,17-18H,10,12-13H2,1-3H3,(H,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 69n/an/an/an/an/an/a



GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC.

US Patent


Assay Description
His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...


US Patent US10155764 (2018)


BindingDB Entry DOI: 10.7270/Q25M67T9
More data for this
Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832]


(Homo sapiens (Human))
BDBM311444
PNG
(CHEM-US-00141 | US10155764, Example 32 | US1015576...)
Show SMILES CN(C)C1CN(CCC1Nc1nn(C)c(=O)c2cccnc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H25ClN6O/c1-26(2)18-13-28(15-8-6-14(22)7-9-15)12-10-17(18)24-20-19-16(5-4-11-23-19)21(29)27(3)25-20/h4-9,11,17-18H,10,12-13H2,1-3H3,(H,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 150n/an/an/an/an/an/a



GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC.

US Patent


Assay Description
His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...


US Patent US10155764 (2018)


BindingDB Entry DOI: 10.7270/Q25M67T9
More data for this
Ligand-Target Pair