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There are 7 purchasable compounds for target: Acid phosphatase (acpB)

Wt: 286.2
BDBM7462
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Wt: 318.2
BDBM15236
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Wt: 235.3
BDBM39344
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Wt: 511.8
BDBM59083
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Wt: 216.1
BDBM92476
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Wt: 929.1
BDBM92478
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Wt: 176.1
BDBM50090256
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 7462,15236,39344,59083,92476,92478,50090256   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM59083
PNG
(MLS002154065 | SMR001233380 | THONZONIUM BROMIDE |...)
Show SMILES CCCCCCCCCCCCCCCC[N+](C)(C)CCN(Cc1ccc(OC)cc1)c1ncccn1
Show InChI InChI=1S/C32H55N4O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27-36(2,3)28-26-35(32-33-24-19-25-34-32)29-30-20-22-31(37-4)23-21-30/h19-25H,5-18,26-29H2,1-4H3/q+1
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590n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


Citation and Details
More data for this
Ligand-Target Pair
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM92476
PNG
((+)-5,6-O-Isopropylidene-L-ascorbic acid)
Show SMILES CC1(C)OC[C@H](O1)[C@H]1OC(=O)C(=O)C1O
Show InChI InChI=1S/C9H12O6/c1-9(2)13-3-4(15-9)7-5(10)6(11)8(12)14-7/h4-5,7,10H,3H2,1-2H3/t4-,5?,7+/m0/s1
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3.27E+3n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


Citation and Details
More data for this
Ligand-Target Pair
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM39344
PNG
(4-amino-N-[2-(diethylamino)ethyl]benzamide;hydroch...)
Show SMILES CCN(CC)CCNC(=O)c1ccc(N)cc1
Show InChI InChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17)
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PubMed
1.48E+4n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


Citation and Details
More data for this
Ligand-Target Pair
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM15236
PNG
(3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chr...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H
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PubMed
1.54E+5n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


Citation and Details
More data for this
Ligand-Target Pair
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM7462
PNG
(3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-...)
Show SMILES Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
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PubMed
1.90E+5n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


Citation and Details
More data for this
Ligand-Target Pair
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM92478
PNG
(Atracurium besylate | CHEMBL1360)
Show SMILES COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)CCC(=O)OCCCCCOC(=O)CC[N+]2(C)CCc3cc(OC)c(OC)cc3C2Cc2ccc(OC)c(OC)c2)cc1OC
Show InChI InChI=1S/C53H72N2O12/c1-54(22-18-38-32-48(62-7)50(64-9)34-40(38)42(54)28-36-14-16-44(58-3)46(30-36)60-5)24-20-52(56)66-26-12-11-13-27-67-53(57)21-25-55(2)23-19-39-33-49(63-8)51(65-10)35-41(39)43(55)29-37-15-17-45(59-4)47(31-37)61-6/h14-17,30-35,42-43H,11-13,18-29H2,1-10H3/q+2
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PubMed
3.42E+5n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


Citation and Details
More data for this
Ligand-Target Pair
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM50090256
PNG
((R)-2-((S)-1,2-dihydroxyethyl)-4,5-dihydroxyfuran-...)
Show SMILES OC[C@H](O)c1oc(O)c(O)c1O
Show InChI InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,7-11H,1H2/t2-/m0/s1
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PC cid
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Article
PubMed
3.80E+5n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


Citation and Details
More data for this
Ligand-Target Pair