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Compile Data Set for Download or QSAR

Found 34 hits with Last Name = 'weigel' and Initial = 'p'   
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
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50118214
PNG
(CHEMBL133930 | DIDS)
Show SMILES [O-]S(=O)(=O)c1cc(ccc1\C=C\c1ccc(cc1S([O-])(=O)=O)N=C=S)N=C=S
Show InChI InChI=1S/C16H10N2O6S4/c19-27(20,21)15-7-13(17-9-25)5-3-11(15)1-2-12-4-6-14(18-10-26)8-16(12)28(22,23)24/h1-8H,(H,19,20,21)(H,22,23,24)/p-2/b2-1+
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Citation and Details
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50118214
PNG
(CHEMBL133930 | DIDS)
Show SMILES [O-]S(=O)(=O)c1cc(ccc1\C=C\c1ccc(cc1S([O-])(=O)=O)N=C=S)N=C=S
Show InChI InChI=1S/C16H10N2O6S4/c19-27(20,21)15-7-13(17-9-25)5-3-11(15)1-2-12-4-6-14(18-10-26)8-16(12)28(22,23)24/h1-8H,(H,19,20,21)(H,22,23,24)/p-2/b2-1+
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Citation and Details
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50118214
PNG
(CHEMBL133930 | DIDS)
Show SMILES [O-]S(=O)(=O)c1cc(ccc1\C=C\c1ccc(cc1S([O-])(=O)=O)N=C=S)N=C=S
Show InChI InChI=1S/C16H10N2O6S4/c19-27(20,21)15-7-13(17-9-25)5-3-11(15)1-2-12-4-6-14(18-10-26)8-16(12)28(22,23)24/h1-8H,(H,19,20,21)(H,22,23,24)/p-2/b2-1+
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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614578
PNG
(CHEMBL5280045)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(ccc1\[#6]=[#6]\c1ccc(cc1S([#8-])(=O)=O)C#N)C#N
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n/an/a 1.30E+3n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614586
PNG
(CHEMBL5287027)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(-[#7]-[#6](=O)-[#8]-c2ccccc2)ccc1\[#6]=[#6]\c1ccc(-[#7]-[#6](=O)-[#8]-c2ccccc2)cc1S([#8-])(=O)=O
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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614584
PNG
(CHEMBL5277728)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#8]-c1ccc(cc1)-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]-[#6](=O)-c3ccc(-[#8]-[#6])cc3)cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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n/an/a 3.00E+3n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614586
PNG
(CHEMBL5287027)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(-[#7]-[#6](=O)-[#8]-c2ccccc2)ccc1\[#6]=[#6]\c1ccc(-[#7]-[#6](=O)-[#8]-c2ccccc2)cc1S([#8-])(=O)=O
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n/an/a 3.80E+3n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614578
PNG
(CHEMBL5280045)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(ccc1\[#6]=[#6]\c1ccc(cc1S([#8-])(=O)=O)C#N)C#N
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n/an/a 4.90E+3n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614584
PNG
(CHEMBL5277728)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#8]-c1ccc(cc1)-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]-[#6](=O)-c3ccc(-[#8]-[#6])cc3)cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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n/an/a 6.50E+3n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614580
PNG
(CHEMBL5269627)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(ccc1\[#6]=[#6]\c1ccc(cc1S([#8-])(=O)=O)-[#7]=[N+]=[#7-])-[#7]=[N+]=[#7-]
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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614579
PNG
(CHEMBL5267208)
Show SMILES [K;v0+].[K;v0+].[#8-]S(=O)(=O)c1cc(I)ccc1\[#6]=[#6]\c1ccc(I)cc1S([#8-])(=O)=O
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614590
PNG
(CHEMBL5272279)
Show SMILES [Na;v0+].[Na;v0+].[#8-]-[#7+](=O)-c1ccc(\[#6]=[#6]\c2ccc(cc2S([#8-])(=O)=O)C#N)c(c1)S([#8-])(=O)=O
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM39120
PNG
(3-chloranyl-1-(3,4-dichlorophenyl)-4-morpholin-4-y...)
Show SMILES ClC1=C(N2CCOCC2)C(=O)N(C1=O)c1ccc(Cl)c(Cl)c1 |c:1|
Show InChI InChI=1S/C14H11Cl3N2O3/c15-9-2-1-8(7-10(9)16)19-13(20)11(17)12(14(19)21)18-3-5-22-6-4-18/h1-2,7H,3-6H2
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n/an/a 2.00E+4n/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614580
PNG
(CHEMBL5269627)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(ccc1\[#6]=[#6]\c1ccc(cc1S([#8-])(=O)=O)-[#7]=[N+]=[#7-])-[#7]=[N+]=[#7-]
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n/an/a 2.15E+4n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM48804
PNG
(3-(phenylmethyl)-2-[(E)-2-(3-pyridinyl)ethenyl]-4-...)
Show SMILES O=c1n(Cc2ccccc2)c(\C=C\c2cccnc2)nc2ccccc12
Show InChI InChI=1S/C22H17N3O/c26-22-19-10-4-5-11-20(19)24-21(13-12-17-9-6-14-23-15-17)25(22)16-18-7-2-1-3-8-18/h1-15H,16H2/b13-12+
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n/an/a 2.74E+4n/an/an/an/an/an/a


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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614589
PNG
(CHEMBL5287615)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(cc2S([#8-])(=O)=O)-[#7]=C=S)c(c1)S([#8-])(=O)=O
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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614589
PNG
(CHEMBL5287615)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(cc2S([#8-])(=O)=O)-[#7]=C=S)c(c1)S([#8-])(=O)=O
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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614593
PNG
(CHEMBL5278453)
Show SMILES [Na;v0+].[Na;v0+].[#6]-c1ccc(cc1)S(=O)(=O)[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]S(=O)(=O)c3ccc(-[#6])cc3)cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614597
PNG
(CHEMBL5274741)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(-[#7]-[#6](=O)-[#8]-c2ccccc2)ccc1-[#6]-[#6]-c1ccc(-[#7]-[#6](=O)-[#8]-c2ccccc2)cc1S([#8-])(=O)=O
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n/an/a 3.00E+4n/an/an/an/an/an/a


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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614598
PNG
(CHEMBL5286345)
Show SMILES O=C(Nc1ccc(\C=C\c2ccc(NC(=O)Oc3ccccc3)cc2)cc1)Oc1ccccc1
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n/an/a 3.05E+4n/an/an/an/an/an/a


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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614579
PNG
(CHEMBL5267208)
Show SMILES [K;v0+].[K;v0+].[#8-]S(=O)(=O)c1cc(I)ccc1\[#6]=[#6]\c1ccc(I)cc1S([#8-])(=O)=O
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n/an/a 3.40E+4n/an/an/an/an/an/a


TBA



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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614592
PNG
(CHEMBL5273677)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(-[#7]S(=O)(=O)c2ccccc2)ccc1\[#6]=[#6]\c1ccc(-[#7]S(=O)(=O)c2ccccc2)cc1S([#8-])(=O)=O
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n/an/a 4.13E+4n/an/an/an/an/an/a


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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614580
PNG
(CHEMBL5269627)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(ccc1\[#6]=[#6]\c1ccc(cc1S([#8-])(=O)=O)-[#7]=[N+]=[#7-])-[#7]=[N+]=[#7-]
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n/an/a 4.43E+4n/an/an/an/an/an/a


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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614596
PNG
(CHEMBL5276360)
Show SMILES COS(=O)(=O)c1cc(NC(=O)Oc2ccccc2)ccc1\C=C\c1ccc(NC(=O)Oc2ccccc2)cc1S(=O)(=O)OC
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614599
PNG
(CHEMBL5278397)
Show SMILES O=S(=O)(Nc1ccc(\C=C\c2ccc(NS(=O)(=O)c3ccccc3)cc2)cc1)c1ccccc1
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More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614582
PNG
(CHEMBL5284017)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#6]-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]-[#6](=O)-[#6]-[#6])cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614581
PNG
(CHEMBL5281504)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]-[#6](-[#6])=O)cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614587
PNG
(CHEMBL5287526)
Show SMILES [Na;v0+].[Na;v0+].[#8-]-[#7+](=O)-c1ccc(\[#6]=[#6]\c2ccc(cc2S([#8-])(=O)=O)-[#7+](-[#8-])=O)c(c1)S([#8-])(=O)=O
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614583
PNG
(CHEMBL5283877)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(-[#7]-[#6](=O)-c2ccccc2)ccc1\[#6]=[#6]\c1ccc(-[#7]-[#6](=O)-c2ccccc2)cc1S([#8-])(=O)=O
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614595
PNG
(CHEMBL5279331)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#6](-[#6])-[#6]-[#8]-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]-[#6](=O)-[#8]-[#6]-[#6](-[#6])-[#6])cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614594
PNG
(CHEMBL5283187)
Show SMILES [Na;v0+].[Na;v0+].[#8-]-[#7+](=O)-c1ccc(cc1)S(=O)(=O)[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]S(=O)(=O)c3ccc(cc3)-[#7+](-[#8-])=O)cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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n/an/a>5.00E+4n/an/an/an/an/an/a


TBA



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Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614588
PNG
(CHEMBL5267296)
Show SMILES [Na;v0+].[Na;v0+].[#8-]S(=O)(=O)c1cc(ccc1-[#6]-[#6]-c1ccc(cc1S([#8-])(=O)=O)C#N)C#N
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Citation and Details
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614591
PNG
(CHEMBL5273057)
Show SMILES [N-]=[N+]=Nc1ccc(\C=C\c2ccc(cc2)N=[N+]=[N-])cc1
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Citation and Details
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM50614585
PNG
(CHEMBL5275181)
Show SMILES [Na;v0+].[Na;v0+].[#6]-[#6]-[#8]-[#6](=O)-[#7]-c1ccc(\[#6]=[#6]\c2ccc(-[#7]-[#6](=O)-[#8]-[#6]-[#6])cc2S([#8-])(=O)=O)c(c1)S([#8-])(=O)=O
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UniChem
n/an/a>5.00E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair