BDBM11845 2-[(2-nitrobenzene)sulfonamido]-3-phenyl-N-{1-[(5-sulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]ethyl}propanamide::5-mercapto-1,3,4-thiadiazole 12j

SMILES CC(NC(=O)C(Cc1ccccc1)NS(=O)(=O)c1ccccc1[N+]([O-])=O)C(=O)Nc1nnc(S)s1

InChI Key InChIKey=LBXQNROQWCXYOR-UHFFFAOYSA-N

Data  5 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 11845   

TargetMatrix metalloproteinase-9(Human)
Universita Degli Studi Di Firenze

LigandPNGBDBM11845(2-[(2-nitrobenzene)sulfonamido]-3-phenyl-N-{1-[(5-...)
Affinity DataKi:  1.40E+4nMAssay Description:Initial rates for the hydrolysis of the thioester substrate were used for assessing the catalytic activity and inhibition of the MMPs by the spectrop...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/6/2006
Entry Details Article
PubMed
Target72 kDa type IV collagenase(Human)
Universita Degli Studi Di Firenze

LigandPNGBDBM11845(2-[(2-nitrobenzene)sulfonamido]-3-phenyl-N-{1-[(5-...)
Affinity DataKi:  1.50E+4nMAssay Description:Initial rates for the hydrolysis of the thioester substrate were used for assessing the catalytic activity and inhibition of the MMPs by the spectrop...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/6/2006
Entry Details Article
PubMed
TargetCollagenase ColG(Hathewaya histolytica)
Universita Degli Studi Di Firenze

LigandPNGBDBM11845(2-[(2-nitrobenzene)sulfonamido]-3-phenyl-N-{1-[(5-...)
Affinity DataKi:  1.50E+4nMAssay Description:Initial rates for the hydrolysis of the thioester substrate were used for assessing the catalytic activity and inhibition of the MMPs by the spectrop...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/6/2006
Entry Details Article
PubMed
TargetNeutrophil collagenase(Human)
Universita Degli Studi Di Firenze

LigandPNGBDBM11845(2-[(2-nitrobenzene)sulfonamido]-3-phenyl-N-{1-[(5-...)
Affinity DataKi:  1.70E+4nMAssay Description:Initial rates for the hydrolysis of the thioester substrate were used for assessing the catalytic activity and inhibition of the MMPs by the spectrop...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/6/2006
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Universita Degli Studi Di Firenze

LigandPNGBDBM11845(2-[(2-nitrobenzene)sulfonamido]-3-phenyl-N-{1-[(5-...)
Affinity DataKi:  2.90E+4nM ΔG°:  -6.12kcal/molepH: 6.0 T: 2°CAssay Description:Initial rates for the hydrolysis of the thioester substrate were used for assessing the catalytic activity and inhibition of the MMPs by the spectrop...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/6/2006
Entry Details Article
PubMed