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Compile Data Set for Download or QSAR

Found 43 hits Enz. Inhib. hit(s) with all data for entry = 50011952   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM14680
PNG
(2-formylphenoxyphosphonic acid | 2-formylphenyl di...)
Show SMILES OP(O)(=O)Oc1ccccc1C=O
Show InChI InChI=1S/C7H7O5P/c8-5-6-3-1-2-4-7(6)12-13(9,10)11/h1-5H,(H2,9,10,11)
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n/an/a 2.00E+5n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112464
PNG
(CHEMBL26549 | Phosphoric acid mono-(8-hydroxy-3,4-...)
Show SMILES Oc1cccc2CCCN(OP(O)(O)=O)c12
Show InChI InChI=1S/C9H12NO5P/c11-8-5-1-3-7-4-2-6-10(9(7)8)15-16(12,13)14/h1,3,5,11H,2,4,6H2,(H2,12,13,14)
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n/an/a 3.00E+5n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112470
PNG
(CHEMBL279466 | Phosphoric acid mono-(2,6-diformyl-...)
Show SMILES OP(O)(=O)Oc1c(C=O)cccc1C=O
Show InChI InChI=1S/C8H7O6P/c9-4-6-2-1-3-7(5-10)8(6)14-15(11,12)13/h1-5H,(H2,11,12,13)
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n/an/a 5.00E+5n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112456
PNG
(CHEMBL287216 | Phosphoric acid mono-(4-amino-pheny...)
Show SMILES Nc1ccc(OP(O)(O)=O)cc1
Show InChI InChI=1S/C6H8NO4P/c7-5-1-3-6(4-2-5)11-12(8,9)10/h1-4H,7H2,(H2,8,9,10)
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n/an/a 6.00E+5n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112450
PNG
(CHEMBL24656 | {[4-(benzyloxy)phenyl]amino}carbonyl...)
Show SMILES OP(O)(=O)C(=O)Nc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C14H14NO5P/c16-14(21(17,18)19)15-12-6-8-13(9-7-12)20-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,15,16)(H2,17,18,19)
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n/an/a 8.00E+5n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM14679
PNG
(2-formyl-6-methoxyphenoxyphosphonic acid | 2-formy...)
Show SMILES COc1cccc(C=O)c1OP(O)(O)=O
Show InChI InChI=1S/C8H9O6P/c1-13-7-4-2-3-6(5-9)8(7)14-15(10,11)12/h2-5H,1H3,(H2,10,11,12)
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n/an/a 9.00E+5n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112452
PNG
(CHEMBL25431 | Phosphoric acid mono-naphthalen-2-yl...)
Show SMILES OP(O)(=O)Oc1ccc2ccccc2c1
Show InChI InChI=1S/C10H9O4P/c11-15(12,13)14-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H2,11,12,13)
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n/an/a 1.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50080266
PNG
(CHEMBL24745 | Phosphoric acid mono-naphthalen-1-yl...)
Show SMILES OP(O)(=O)Oc1cccc2ccccc12
Show InChI InChI=1S/C10H9O4P/c11-15(12,13)14-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H2,11,12,13)
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n/an/a 1.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM24514
PNG
(4-nitrophenoxyphosphonic acid | 4-nitrophenyl phos...)
Show SMILES OP(O)(=O)Oc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)
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n/an/a 1.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112460
PNG
(CHEMBL24336 | Phosphoric acid mono-(4-trifluoromet...)
Show SMILES OP(O)(=O)Oc1ccc(SC(F)(F)F)cc1
Show InChI InChI=1S/C7H6F3O4PS/c8-7(9,10)16-6-3-1-5(2-4-6)14-15(11,12)13/h1-4H,(H2,11,12,13)
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n/an/a 1.20E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112467
PNG
(CHEMBL24164 | Phosphoric acid mono-p-tolyl ester)
Show SMILES Cc1ccc(OP(O)(O)=O)cc1
Show InChI InChI=1S/C7H9O4P/c1-6-2-4-7(5-3-6)11-12(8,9)10/h2-5H,1H3,(H2,8,9,10)
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n/an/a 2.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112448
PNG
(2-Phosphonooxy-benzoic acid | CHEMBL287275 | Fosfo...)
Show SMILES OC(=O)c1ccccc1OP(O)(O)=O
Show InChI InChI=1S/C7H7O6P/c8-7(9)5-3-1-2-4-6(5)13-14(10,11)12/h1-4H,(H,8,9)(H2,10,11,12)
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n/an/a 2.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112442
PNG
(CHEMBL25950 | [(3,4,5-trimethoxyphenyl)amino]carbo...)
Show SMILES COc1cc(NC(=O)P(O)(O)=O)cc(OC)c1OC
Show InChI InChI=1S/C10H14NO7P/c1-16-7-4-6(11-10(12)19(13,14)15)5-8(17-2)9(7)18-3/h4-5H,1-3H3,(H,11,12)(H2,13,14,15)
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n/an/a 2.10E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112458
PNG
(CHEMBL26438 | Phosphoric acid 2-formyl-phenyl este...)
Show SMILES CC(C)OP(O)(=O)Oc1ccccc1C=O
Show InChI InChI=1S/C10H13O5P/c1-8(2)14-16(12,13)15-10-6-4-3-5-9(10)7-11/h3-8H,1-2H3,(H,12,13)
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n/an/a 2.10E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM14685
PNG
((cyclohexylmethoxy)(2-formylphenoxy)phosphinic aci...)
Show SMILES OP(=O)(OCC1CCCCC1)Oc1ccccc1C=O
Show InChI InChI=1S/C14H19O5P/c15-10-13-8-4-5-9-14(13)19-20(16,17)18-11-12-6-2-1-3-7-12/h4-5,8-10,12H,1-3,6-7,11H2,(H,16,17)
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n/an/a 2.30E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112457
PNG
(CHEMBL287306 | Phosphoric acid mono-(3-formyl-phen...)
Show SMILES OP(O)(=O)Oc1cccc(C=O)c1
Show InChI InChI=1S/C7H7O5P/c8-5-6-2-1-3-7(4-6)12-13(9,10)11/h1-5H,(H2,9,10,11)
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n/an/a 2.40E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112445
PNG
(CHEMBL24730 | [Hydroxy-(4-propoxy-phenyl)-methyl]-...)
Show SMILES CCCOc1ccc(cc1)C(=O)P(O)(O)O
Show InChI InChI=1S/C10H15O5P/c1-2-7-15-9-5-3-8(4-6-9)10(11)16(12,13)14/h3-6,12-14,16H,2,7H2,1H3
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n/an/a 2.40E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM14675
PNG
(CHEMBL26128 | Fragment 5 | Phenylphosphate | pheno...)
Show SMILES OP(O)(=O)Oc1ccccc1
Show InChI InChI=1S/C6H7O4P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)
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n/an/a 2.50E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112454
PNG
(3-Phosphonooxy-naphthalene-2-carboxylic acid methy...)
Show SMILES COC(=O)c1cc2ccccc2cc1OP(O)(O)=O
Show InChI InChI=1S/C12H11O6P/c1-17-12(13)10-6-8-4-2-3-5-9(8)7-11(10)18-19(14,15)16/h2-7H,1H3,(H2,14,15,16)
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n/an/a 3.20E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112453
PNG
(CHEMBL24060 | Phosphoric acid 2-formyl-phenyl este...)
Show SMILES COP(O)(=O)Oc1ccccc1C=O
Show InChI InChI=1S/C8H9O5P/c1-12-14(10,11)13-8-5-3-2-4-7(8)6-9/h2-6H,1H3,(H,10,11)
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n/an/a 3.30E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112469
PNG
(CHEMBL285775 | Phosphoric acid mono-(2-acetyl-naph...)
Show SMILES CC(=O)c1ccc2ccccc2c1OP(O)(O)=O
Show InChI InChI=1S/C12H11O5P/c1-8(13)10-7-6-9-4-2-3-5-11(9)12(10)17-18(14,15)16/h2-7H,1H3,(H2,14,15,16)
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n/an/a 3.50E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112472
PNG
(CHEMBL26404 | Phosphoric acid mono-(2-chloro-pheny...)
Show SMILES OP(O)(=O)Oc1ccccc1Cl
Show InChI InChI=1S/C6H6ClO4P/c7-5-3-1-2-4-6(5)11-12(8,9)10/h1-4H,(H2,8,9,10)
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n/an/a 3.50E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112461
PNG
(CHEMBL26164 | {[4-(ethoxycarbonyl)phenyl]amino}car...)
Show SMILES CCOC(=O)c1ccc(NC(=O)P(O)(O)=O)cc1
Show InChI InChI=1S/C10H12NO6P/c1-2-17-9(12)7-3-5-8(6-4-7)11-10(13)18(14,15)16/h3-6H,2H2,1H3,(H,11,13)(H2,14,15,16)
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n/an/a 3.60E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112462
PNG
(CHEMBL24771 | [(4-butoxyphenyl)amino]carbonylphosp...)
Show SMILES CCCCOc1ccc(NC(=O)P(O)(O)=O)cc1
Show InChI InChI=1S/C11H16NO5P/c1-2-3-8-17-10-6-4-9(5-7-10)12-11(13)18(14,15)16/h4-7H,2-3,8H2,1H3,(H,12,13)(H2,14,15,16)
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n/an/a 3.90E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112449
PNG
(3-Phosphonooxy-benzoic acid methyl ester | CHEMBL2...)
Show SMILES COC(=O)c1cccc(OP(O)(O)=O)c1
Show InChI InChI=1S/C8H9O6P/c1-13-8(9)6-3-2-4-7(5-6)14-15(10,11)12/h2-5H,1H3,(H2,10,11,12)
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n/an/a 4.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112447
PNG
(CHEMBL287555 | Phosphoric acid mono-m-tolyl ester)
Show SMILES Cc1cccc(OP(O)(O)=O)c1
Show InChI InChI=1S/C7H9O4P/c1-6-3-2-4-7(5-6)11-12(8,9)10/h2-5H,1H3,(H2,8,9,10)
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n/an/a 4.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112443
PNG
(CHEMBL25780 | Phosphoric acid mono-(4-tert-butyl-p...)
Show SMILES CC(C)(C)c1ccc(OP(O)(O)=O)cc1
Show InChI InChI=1S/C10H15O4P/c1-10(2,3)8-4-6-9(7-5-8)14-15(11,12)13/h4-7H,1-3H3,(H2,11,12,13)
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n/an/a 4.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112440
PNG
(CHEMBL26166 | {[2-(trifluoromethoxy)phenyl]amino}c...)
Show SMILES OP(O)(=O)C(=O)Nc1ccccc1OC(F)(F)F
Show InChI InChI=1S/C8H7F3NO5P/c9-8(10,11)17-6-4-2-1-3-5(6)12-7(13)18(14,15)16/h1-4H,(H,12,13)(H2,14,15,16)
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112468
PNG
(4-Phosphonooxy-benzoic acid methyl ester | CHEMBL2...)
Show SMILES COC(=O)c1ccc(OP(O)(O)=O)cc1
Show InChI InChI=1S/C8H9O6P/c1-13-8(9)6-2-4-7(5-3-6)14-15(10,11)12/h2-5H,1H3,(H2,10,11,12)
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112466
PNG
(CHEMBL24124 | Phosphoric acid mono-(4-methoxy-phen...)
Show SMILES COc1ccc(OP(O)(O)=O)cc1
Show InChI InChI=1S/C7H9O5P/c1-11-6-2-4-7(5-3-6)12-13(8,9)10/h2-5H,1H3,(H2,8,9,10)
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n/an/a 4.00E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM14687
PNG
(CHEMBL284362 | Fragment 17 | ISO24 | [(4-ETHYLPHEN...)
Show SMILES CCc1ccc(NC(=O)P(O)(O)=O)cc1
Show InChI InChI=1S/C9H12NO4P/c1-2-7-3-5-8(6-4-7)10-9(11)15(12,13)14/h3-6H,2H2,1H3,(H,10,11)(H2,12,13,14)
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n/an/a 4.40E+6n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112441
PNG
((benzylamino)carbonylphosphonic acid | CHEMBL28727...)
Show SMILES OP(O)(=O)C(=O)NCc1ccccc1
Show InChI InChI=1S/C8H10NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)(H2,11,12,13)
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50011995
PNG
((Hydroxy-naphthalen-2-yl-methyl)-phosphonic acid |...)
Show SMILES OP(O)(O)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C11H11O4P/c12-11(16(13,14)15)10-6-5-8-3-1-2-4-9(8)7-10/h1-7,13-16H
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM14683
PNG
(CHEMBL286758 | DPI59 | Fragment 13 | [hydroxy(1-na...)
Show SMILES OP(O)(O)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C11H11O4P/c12-11(16(13,14)15)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,13-16H
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112446
PNG
(CHEMBL24447 | [(2-phenylethyl)amino]carbonylphosph...)
Show SMILES OP(O)(=O)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C9H12NO4P/c11-9(15(12,13)14)10-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)(H2,12,13,14)
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112444
PNG
(CHEMBL24645 | [Hydroxy-(4-isopropyl-phenyl)-methyl...)
Show SMILES CC(C)c1ccc(cc1)C(=O)P(O)(O)O
Show InChI InChI=1S/C10H15O4P/c1-7(2)8-3-5-9(6-4-8)10(11)15(12,13)14/h3-7,12-15H,1-2H3
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112463
PNG
((Biphenyl-4-yl-hydroxy-methyl)-phosphonic acid | C...)
Show SMILES OP(O)(O)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C13H13O4P/c14-13(18(15,16)17)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,15-18H
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112459
PNG
(CHEMBL286467 | Phosphoric acid mono-(2-cyano-8-hyd...)
Show SMILES Oc1cccc2CC=C(C#N)N(OP(O)(O)=O)c12 |t:7|
Show InChI InChI=1S/C10H9N2O5P/c11-6-8-5-4-7-2-1-3-9(13)10(7)12(8)17-18(14,15)16/h1-3,5,13H,4H2,(H2,14,15,16)
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112451
PNG
(CHEMBL26349 | Phosphoric acid mono-(2,6-dimethyl-p...)
Show SMILES Cc1cccc(C)c1OP(O)(O)=O
Show InChI InChI=1S/C8H11O4P/c1-6-4-3-5-7(2)8(6)12-13(9,10)11/h3-5H,1-2H3,(H2,9,10,11)
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112455
PNG
((Hydroxy-phenyl-methyl)-phosphonic acid | Alpha Hy...)
Show SMILES OP(O)(O)C(=O)c1ccccc1
Show InChI InChI=1S/C7H9O4P/c8-7(12(9,10)11)6-4-2-1-3-5-6/h1-5,9-12H
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112439
PNG
((Cyclohexyl-hydroxy-methyl)-phosphonic acid | CHEM...)
Show SMILES OP(O)(O)C(=O)C1CCCCC1
Show InChI InChI=1S/C7H15O4P/c8-7(12(9,10)11)6-4-2-1-3-5-6/h6,9-12H,1-5H2
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112465
PNG
(CHEMBL24648 | [Hydroxy-(2-methoxy-phenyl)-methyl]-...)
Show SMILES COc1ccccc1C(=O)P(O)(O)O
Show InChI InChI=1S/C8H11O5P/c1-13-7-5-3-2-4-6(7)8(9)14(10,11)12/h2-5,10-12,14H,1H3
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))		BDBM50112471
PNG
(CHEMBL285665 | Phosphoric acid mono-(8-hydroxy-8aH...)
Show SMILES Oc1cccc2CC=CN(OP(O)(O)=O)c12 |c:7|
Show InChI InChI=1S/C9H10NO5P/c11-8-5-1-3-7-4-2-6-10(9(7)8)15-16(12,13)14/h1-3,5-6,11H,4H2,(H2,12,13,14)
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Aventis Pharma

Curated by ChEMBL


Assay Description
The compound was evaluated for its binding affinity towards phosphotyrosine binding pocket of Src protein tryrosine kinase SH2 domain

Bioorg Med Chem Lett 12: 1295-8 (2002)


BindingDB Entry DOI: 10.7270/Q2959GW0
More data for this
Ligand-Target Pair