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BDBM209899 US9273014, 28

SMILES: Cc1cccc(c1)C1=N[C@H](NC(=O)[C@H](CCC(F)(F)F)[C@H](CCC(F)(F)F)C(N)=O)C(=O)Nc2c(Cl)cccc12

InChI Key: InChIKey=AHQDKFUMSUHJRJ-WJONJSRFSA-N

Data: 2 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 2 hits for monomerid = 209899   
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
Notch 3 intracellular domain (Notch 3)


(Homo sapiens (Human))
BDBM209899
PNG
(US9273014, 28)
Show SMILES Cc1cccc(c1)C1=N[C@H](NC(=O)[C@H](CCC(F)(F)F)[C@H](CCC(F)(F)F)C(N)=O)C(=O)Nc2c(Cl)cccc12 |r,t:8|
Show InChI InChI=1S/C26H25ClF6N4O3/c1-13-4-2-5-14(12-13)19-17-6-3-7-18(27)20(17)36-24(40)22(35-19)37-23(39)16(9-11-26(31,32)33)15(21(34)38)8-10-25(28,29)30/h2-7,12,15-16,22H,8-11H2,1H3,(H2,34,38)(H,36,40)(H,37,39)/t15-,16+,22+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 7.20n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The pharmacological properties of the compounds of this invention may be confirmed by a number of biological assays.


US Patent US9273014 (2016)


BindingDB Entry DOI: 10.7270/Q2KW5DVX
More data for this
Ligand-Target Pair
Notch 1 intracellular domain (Notch 1)


(Homo sapiens (Human))
BDBM209899
PNG
(US9273014, 28)
Show SMILES Cc1cccc(c1)C1=N[C@H](NC(=O)[C@H](CCC(F)(F)F)[C@H](CCC(F)(F)F)C(N)=O)C(=O)Nc2c(Cl)cccc12 |r,t:8|
Show InChI InChI=1S/C26H25ClF6N4O3/c1-13-4-2-5-14(12-13)19-17-6-3-7-18(27)20(17)36-24(40)22(35-19)37-23(39)16(9-11-26(31,32)33)15(21(34)38)8-10-25(28,29)30/h2-7,12,15-16,22H,8-11H2,1H3,(H2,34,38)(H,36,40)(H,37,39)/t15-,16+,22+/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.80n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The pharmacological properties of the compounds of this invention may be confirmed by a number of biological assays.


US Patent US9273014 (2016)


BindingDB Entry DOI: 10.7270/Q2KW5DVX
More data for this
Ligand-Target Pair