BindingDB PrimarySearch_ki

Search and Browse
- Target
- Compound
- Special tools
- Citation
- Special Data 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

BDBM50076370 (S)-N,N-Dimethyl-3-phenyl-2-[3-(5-thioxo-4,5-dihydro-[1,3,4]thiadiazol-2-yl)-ureido]-propionamide::CHEMBL40034

SMILES: CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)Nc1nnc(S)s1

InChI Key: InChIKey=LUPLBSDRRWYFTC-UHFFFAOYSA-N

Data: 4 KI

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50076370
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Stromelysin-1 (Human)	BDBM50076370 ((S)-N,N-Dimethyl-3-phenyl-2-[3-(5-thioxo-4,5-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Stromelysin-1 (Human)	BDBM50076370 ((S)-N,N-Dimethyl-3-phenyl-2-[3-(5-thioxo-4,5-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Interstitial collagenase (Human)	BDBM50076370 ((S)-N,N-Dimethyl-3-phenyl-2-[3-(5-thioxo-4,5-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		2.26E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Human)	BDBM50076370 ((S)-N,N-Dimethyl-3-phenyl-2-[3-(5-thioxo-4,5-dihyd...) Show SMILES Show InChI	GoogleScholar	UniChem		2.26E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair