BDBM50199733 CHEMBL396296::methotrexate gamma-L-phenylalaninehydroxamic acid

SMILES CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)NO)C(O)=O

InChI Key InChIKey=QHQOEZXEZMHMER-UHFFFAOYSA-N

Data  6 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50199733   

Target72 kDa type IV collagenase(Human)
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Curated by ChEMBL
LigandPNGBDBM50199733(methotrexate gamma-L-phenylalaninehydroxamic acid ...)
Affinity DataIC50: 6.00E+4nMAssay Description:Inhibition of human recombinant MMP2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetDihydrofolate reductase(Human)
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Curated by ChEMBL
LigandPNGBDBM50199733(methotrexate gamma-L-phenylalaninehydroxamic acid ...)
Affinity DataIC50: 170nMAssay Description:Inhibition of DHFR using dihydrofolic acid substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetDihydrofolate reductase(Human)
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Curated by ChEMBL
LigandPNGBDBM50199733(methotrexate gamma-L-phenylalaninehydroxamic acid ...)
Affinity DataIC50: 250nMAssay Description:Inhibition of DHFR using folic acid substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetMatrilysin(Human)
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Curated by ChEMBL
LigandPNGBDBM50199733(methotrexate gamma-L-phenylalaninehydroxamic acid ...)
Affinity DataIC50: 4.40E+4nMAssay Description:Inhibition of human recombinant MMP7More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetMatrix metalloproteinase-14(Human)
Instituto Superior T£Cnico

Curated by ChEMBL
LigandPNGBDBM50199733(methotrexate gamma-L-phenylalaninehydroxamic acid ...)
Affinity DataIC50: 7.00E+4nMAssay Description:Inhibition of human recombinant MMP14More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetMatrix metalloproteinase-9(Human)
Instituto Superior T£Cnico

Curated by ChEMBL
LigandPNGBDBM50199733(methotrexate gamma-L-phenylalaninehydroxamic acid ...)
Affinity DataIC50: 1.50E+4nMAssay Description:Inhibition of human recombinant MMP9More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed