Go
myBDB
logout
Search and Browse
Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
pH (Enzymatic Assay)
pH (ITC)
Substrate or Competitor
Compound Mol. Wt.
Chemical Structure
Pathways
Source Organism
Number of Compounds
Monomer List in csv
Het List in SDF
Compound
FDA Drugs
Important Compounds
Chemical Structure
Name
SMILES
Number of Data
/
Targets
Special tools
3D Structure Series
Find My Compound's Targets
Find Compounds for My Targets
Do Virtual Screening
SCOP
Citation
Author
Journal/Citation
Institution
PubMed
PubChem BioAssay
US Patent
Special Data Sets
Host Guest Systems
Prot-Lig Validation Sets
Other Databases
PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
PubMed
Download
All Compounds & Data
Target Names &
Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
Enter Data
Deposition
Contribute data
Sent Comments
Full input and output files for computationally docked structures of congeneric ligands similar to
BDBM31913
=
CAR
in crystal structure
3ERN
3ERN-results_BindingDB_31913.mol2
prot-log.txt
BindingDB_31915.docklog.results_tab.log
BindingDB_31909.frags.mol2
3ERN-voxthresh-4.pdb
BindingDB_31915.mol2
BindingDB_31913.frags.mol2
3ERN-protomol.mol2
3ERN-voxthresh-9.pdb
3ERN-voxthresh-8.pdb
3ERN_ligand1.mol2
3ERN-results_tab.log
3ERN.Targets
3ERN-results_BindingDB_31910.mol2
3ERN-voxthresh-3.pdb
CAR.sdf
BindingDB_31910.docklog.results_tab.log
3ERN_sdf.mol2
BindingDB_31915.docklog.mol2
BindingDB_31914.docklog
3ERN-voxthresh-2.pdb
BindingDB_31915.docklog
3ERN_ligand3.mol2
log-results.mol2
BindingDB_31910.mol2
3ERN_sdf-log.txt
3ERN-voxthresh-1.pdb
3ERN_congener.mol2
BindingDB_31909.mol2
3ERN_ligand2.mol2
BindingDB_31914.frags.mol2
BindingDB_31913.docklog.results_tab.log
log-results_tab.log
3ERN_water.mol2
BindingDB_31913.docklog.mol2
protein_sampling.mol2
3ERN.opt-protein-trim.mol2
BindingDB_31909.docklog.mol2
3ERN-voxthresh-7.pdb
BindingDB_31910.frags.mol2
log
BindingDB_31913.mol2
3ERN-results_BindingDB_31909.mol2
BindingDB_31913.docklog
ligand_sampling.mol2
BindingDB_31914.docklog.mol2
3ERN.pdb
3ERN_congener-log.txt
BindingDB_31914.docklog.results_tab.log
BindingDB_31910.docklog.mol2
BindingDB_31910.docklog
3ERN_ligand0.mol2
scale
frag2.mol2
3ERN-voxthresh-6.pdb
prot.mol2
3ERN-voxthresh-10.pdb
bdb_3ERN_CAR_3D.sdf
3ERN-voxthresh-0.pdb
BindingDB_31915.frags.mol2
BindingDB_31914.mol2
3ERN.mol2
bdb_3ERN_CAR_sim.txt
BindingDB_31909.docklog.results_tab.log
BindingDB_31909.docklog
3ERN-results.mol2
3ERN.csv
3ERN-voxthresh-5.pdb
3ERN-marked-protein.pdb
3ERN-marked-vox.pdb
frag1.mol2
3ERN_ligand4.mol2