BDBM50107573 (2R)-2-[4-(1,3-benzodioxol-5-yl)benzyl]-N~4~-hydroxy-N~1~-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]butanediamide::(R)-2-(4-Benzo[1,3]dioxol-5-yl-benzyl)-N*4*-hydroxy-N*1*-((1S,2R)-2-hydroxy-indan-1-yl)-succinamide::CHEMBL8432

SMILES ONC(=O)C[C@@H](Cc1ccc(cc1)-c1ccc2OCOc2c1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12

InChI Key InChIKey=MJTVUROZTDIMFT-MZEQIWSPSA-N

Data  3 KI

PDB links: 2 PDB IDs match this monomer.

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 3 hits for monomerid = 50107573   

Target72 kDa type IV collagenase(Homo sapiens (Human))
Bristol-Myers Squibb Pharma Company

Curated by ChEMBL
LigandPNGBDBM50107573((2R)-2-[4-(1,3-benzodioxol-5-yl)benzyl]-N~4~-hydro...)
Show SMILES ONC(=O)C[C@@H](Cc1ccc(cc1)-c1ccc2OCOc2c1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
Show InChI InChI=1S/C27H26N2O6/c30-22-12-19-3-1-2-4-21(19)26(22)28-27(32)20(14-25(31)29-33)11-16-5-7-17(8-6-16)18-9-10-23-24(13-18)35-15-34-23/h1-10,13,20,22,26,30,33H,11-12,14-15H2,(H,28,32)(H,29,31)/t20-,22-,26+/m1/s1
Affinity DataKi:  43nMAssay Description:Binding affinity for human gelatinase A (MMP-2)More data for this Ligand-Target Pair
TargetMatrix metalloproteinase-9(Homo sapiens (Human))
Bristol-Myers Squibb Pharma Company

Curated by ChEMBL
LigandPNGBDBM50107573((2R)-2-[4-(1,3-benzodioxol-5-yl)benzyl]-N~4~-hydro...)
Show SMILES ONC(=O)C[C@@H](Cc1ccc(cc1)-c1ccc2OCOc2c1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
Show InChI InChI=1S/C27H26N2O6/c30-22-12-19-3-1-2-4-21(19)26(22)28-27(32)20(14-25(31)29-33)11-16-5-7-17(8-6-16)18-9-10-23-24(13-18)35-15-34-23/h1-10,13,20,22,26,30,33H,11-12,14-15H2,(H,28,32)(H,29,31)/t20-,22-,26+/m1/s1
Affinity DataKi:  309nMAssay Description:Binding affinity for human gelatinase B (MMP-9)More data for this Ligand-Target Pair
TargetInterstitial collagenase(Homo sapiens (Human))
Bristol-Myers Squibb Pharma Company

Curated by ChEMBL
LigandPNGBDBM50107573((2R)-2-[4-(1,3-benzodioxol-5-yl)benzyl]-N~4~-hydro...)
Show SMILES ONC(=O)C[C@@H](Cc1ccc(cc1)-c1ccc2OCOc2c1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12
Show InChI InChI=1S/C27H26N2O6/c30-22-12-19-3-1-2-4-21(19)26(22)28-27(32)20(14-25(31)29-33)11-16-5-7-17(8-6-16)18-9-10-23-24(13-18)35-15-34-23/h1-10,13,20,22,26,30,33H,11-12,14-15H2,(H,28,32)(H,29,31)/t20-,22-,26+/m1/s1
Affinity DataKi:  1.28E+4nMAssay Description:Binding affinity for neutrophil collagenase (MMP-1)More data for this Ligand-Target Pair