BindingDB logo
myBDB logout

null

SMILES: C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CC2(C1)CCCOC2

InChI Key: InChIKey=CDCBOMINZHMQDZ-JIQGDJCJSA-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 1 hit for monomerid = 227496   
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
Serine/threonine-protein kinase mTOR


(Homo sapiens (Human))		BDBM227496
PNG
(US9334271, 17)
Show SMILES C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CC2(C1)CCCOC2 |r|
Show InChI InChI=1S/C25H27N7O2/c1-16-12-33-11-9-32(16)23-20-22(28-21(27-20)18-4-2-5-19-17(18)6-8-26-19)29-24(30-23)31-13-25(14-31)7-3-10-34-15-25/h2,4-6,8,16H,3,7,9-15H2,1H3/b21-18-/t16-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 112n/an/an/an/a7.525



Novarits AG

US Patent


Assay Description
1. 8-point serial dilutions of compounds (10 mM stock) are performed in 90% DMSO in a 384-well "masterplate" and 50 nL is transferred onto 384-well a...

US Patent US9334271 (2016)


BindingDB Entry DOI: 10.7270/Q2P55MCT
More data for this
Ligand-Target Pair