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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'CVF-Bb Complex' and Ligand = 'BDBM251392'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
CVF-Bb Complex


(Naja kaouthia (Monocled cobra) (Naja siamensis)-Ho...)
BDBM251392
PNG
(US9452990, 72 | US9452990, 79)
Show SMILES CN[C@H](CC(=O)N1CCN(CC1)c1nc(N)c2cc(OC)c(OC)c(F)c2n1)c1ccccc1 |r|
Show InChI InChI=1/C24H29FN6O3/c1-27-17(15-7-5-4-6-8-15)14-19(32)30-9-11-31(12-10-30)24-28-21-16(23(26)29-24)13-18(33-2)22(34-3)20(21)25/h4-8,13,17,27H,9-12,14H2,1-3H3,(H2,26,28,29)/t17-/s2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 50n/an/an/an/a7.425



NOVARTIS AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9452990 (2016)

More data for this
Ligand-Target Pair
CVF-Bb Complex


(Naja kaouthia (Monocled cobra) (Naja siamensis)-Ho...)
BDBM251392
PNG
(US9452990, 72 | US9452990, 79)
Show SMILES CN[C@H](CC(=O)N1CCN(CC1)c1nc(N)c2cc(OC)c(OC)c(F)c2n1)c1ccccc1 |r|
Show InChI InChI=1/C24H29FN6O3/c1-27-17(15-7-5-4-6-8-15)14-19(32)30-9-11-31(12-10-30)24-28-21-16(23(26)29-24)13-18(33-2)22(34-3)20(21)25/h4-8,13,17,27H,9-12,14H2,1-3H3,(H2,26,28,29)/t17-/s2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 230n/an/an/an/a7.425



NOVARTIS AG

US Patent


Assay Description
CVF-Bb complex prepared from purified cobra venom factor (1 μM), recombinant human complement factor B (expressed in drosophila cells and purifi...


US Patent US9452990 (2016)

More data for this
Ligand-Target Pair