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Compile Data Set for Download or QSAR

Found 31 hits Enz. Inhib. hit(s) with Target = 'Structural polyprotein'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Structural polyprotein


(CHIKV)
BDBM476299
PNG
(US10874683, Example 00106 | US10874683, Example 56...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H13N3O6/c13-3-4-6(14)7(15)8(18-4)12-2-1-5(11-17)10-9(12)16/h1-2,4,6-8,13-15,17H,3H2,(H,10,11,16)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 600n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476335
PNG
(US10874683, Example EIDD-02290-01)
Show SMILES CC(C)(C)C(=O)OCOP(=O)(OCOC(=O)C(C)(C)C)OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C(O)(C#C)[C@H]1O
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 6.44E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476306
PNG
(US10874683, Example EIDD-02054-01)
Show SMILES CONc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2(C)O)c(=O)n1
Show InChI InChI=1S/C11H17N3O6/c1-11(18)8(16)6(5-15)20-9(11)14-4-3-7(13-19-2)12-10(14)17/h3-4,6,8-9,15-16,18H,5H2,1-2H3,(H,12,13,17)/t6-,8+,9-,11?/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.50E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476307
PNG
(US10874683, Example EIDD-02080-01)
Show SMILES CC1(F)[C@@H](O)[C@@H](CO)O[C@H]1n1ccc(NO)nc1=O
Show InChI InChI=1S/C10H14FN3O5/c1-10(11)7(16)5(4-15)19-8(10)14-3-2-6(13-18)12-9(14)17/h2-3,5,7-8,15-16,18H,4H2,1H3,(H,12,13,17)/t5-,7+,8-,10?/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.50E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476308
PNG
(US10874683, Example EIDD-02085-01)
Show SMILES OC[C@H]1O[C@H](C(F)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H12FN3O5/c10-6-7(15)4(3-14)18-8(6)13-2-1-5(12-17)11-9(13)16/h1-2,4,6-8,14-15,17H,3H2,(H,11,12,16)/t4-,6?,7+,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.50E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476309
PNG
(US10874683, Example EIDD-02107-01)
Show SMILES CCCCCCCNC(=O)ONc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C17H28N4O7/c1-2-3-4-5-6-8-18-17(26)28-20-12-7-9-21(16(25)19-12)15-14(24)13(23)11(10-22)27-15/h7,9,11,13-15,22-24H,2-6,8,10H2,1H3,(H,18,26)(H,19,20,25)/t11-,13+,14?,15-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 2.90E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476310
PNG
(US10874683, Example EIDD-02107-02)
Show SMILES CCCCCCCNC(=O)ONc1ccn([C@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C17H28N4O7/c1-2-3-4-5-6-8-18-17(26)28-20-12-7-9-21(16(25)19-12)15-14(24)13(23)11(10-22)27-15/h7,9,11,13-15,22-24H,2-6,8,10H2,1H3,(H,18,26)(H,19,20,25)/t11-,13+,14?,15+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 3.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476299
PNG
(US10874683, Example 00106 | US10874683, Example 56...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H13N3O6/c13-3-4-6(14)7(15)8(18-4)12-2-1-5(11-17)10-9(12)16/h1-2,4,6-8,13-15,17H,3H2,(H,10,11,16)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.80E+3n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476311
PNG
(US10874683, Example EIDD-01910-01)
Show SMILES NNc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C9H14N4O5/c10-12-5-1-2-13(9(17)11-5)8-7(16)6(15)4(3-14)18-8/h1-2,4,6-8,14-16H,3,10H2,(H,11,12,17)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476312
PNG
(US10874683, Example EIDD-02339-01 | US10874683, Ex...)
Show SMILES OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C2(CC2(F)F)[C@H]1O
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476312
PNG
(US10874683, Example EIDD-02339-01 | US10874683, Ex...)
Show SMILES OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C2(CC2(F)F)[C@H]1O
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476314
PNG
(US10874683, Example EIDD-02356-01)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)ONc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C26H46N4O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-27-26(35)37-29-21-16-18-30(25(34)28-21)24-23(33)22(32)20(19-31)36-24/h16,18,20,22-24,31-33H,2-15,17,19H2,1H3,(H,27,35)(H,28,29,34)/t20-,22+,23?,24-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476315
PNG
(US10874683, Example EIDD-02357-01 | US10874683, Ex...)
Show SMILES CCCCCCCCCCCCCCCCCCNC(=O)ONc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C28H50N4O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-29-28(37)39-31-23-18-20-32(27(36)30-23)26-25(35)24(34)22(21-33)38-26/h18,20,22,24-26,33-35H,2-17,19,21H2,1H3,(H,29,37)(H,30,31,36)/t22-,24+,25?,26-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476316
PNG
(US10874683, Example EIDD-02422-01)
Show SMILES CNC(=O)ONc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C11H16N4O7/c1-12-11(20)22-14-6-2-3-15(10(19)13-6)9-8(18)7(17)5(4-16)21-9/h2-3,5,7-9,16-18H,4H2,1H3,(H,12,20)(H,13,14,19)/t5-,7+,8?,9-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 3.20E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476319
PNG
(US10874683, Example EIDD-02423-01)
Show SMILES CN(C)C(=O)ONc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C12H18N4O7/c1-15(2)12(21)23-14-7-3-4-16(11(20)13-7)10-9(19)8(18)6(5-17)22-10/h3-4,6,8-10,17-19H,5H2,1-2H3,(H,13,14,20)/t6-,8+,9?,10-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 2.50E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476315
PNG
(US10874683, Example EIDD-02357-01 | US10874683, Ex...)
Show SMILES CCCCCCCCCCCCCCCCCCNC(=O)ONc1ccn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C28H50N4O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-29-28(37)39-31-23-18-20-32(27(36)30-23)26-25(35)24(34)22(21-33)38-26/h18,20,22,24-26,33-35H,2-17,19,21H2,1H3,(H,29,37)(H,30,31,36)/t22-,24+,25?,26-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 70n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476321
PNG
(US10874683, Example EIDD-02475-01)
Show SMILES CCCCCCCNC(=O)OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C17H28N4O7/c1-2-3-4-5-6-8-18-17(25)27-10-11-13(22)14(23)15(28-11)21-9-7-12(20-26)19-16(21)24/h7,9,11,13-15,22-23,26H,2-6,8,10H2,1H3,(H,18,25)(H,19,20,24)/t11-,13+,14?,15-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476323
PNG
(US10874683, Example EIDD-02476-01)
Show SMILES CCCCCCCCC(=O)OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C18H29N3O7/c1-2-3-4-5-6-7-8-14(22)27-11-12-15(23)16(24)17(28-12)21-10-9-13(20-26)19-18(21)25/h9-10,12,15-17,23-24,26H,2-8,11H2,1H3,(H,19,20,25)/t12-,15+,16?,17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 300n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476299
PNG
(US10874683, Example 00106 | US10874683, Example 56...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H13N3O6/c13-3-4-6(14)7(15)8(18-4)12-2-1-5(11-17)10-9(12)16/h1-2,4,6-8,13-15,17H,3H2,(H,10,11,16)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.80E+3n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476324
PNG
(US10874683, Example EIDD-02504-01)
Show SMILES ONc1cc[nH]c(=O)n1
Show InChI InChI=1S/C4H5N3O2/c8-4-5-2-1-3(6-4)7-9/h1-2,9H,(H2,5,6,7,8)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476299
PNG
(US10874683, Example 00106 | US10874683, Example 56...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H13N3O6/c13-3-4-6(14)7(15)8(18-4)12-2-1-5(11-17)10-9(12)16/h1-2,4,6-8,13-15,17H,3H2,(H,10,11,16)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 2.70E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476299
PNG
(US10874683, Example 00106 | US10874683, Example 56...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H13N3O6/c13-3-4-6(14)7(15)8(18-4)12-2-1-5(11-17)10-9(12)16/h1-2,4,6-8,13-15,17H,3H2,(H,10,11,16)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.50E+3n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476299
PNG
(US10874683, Example 00106 | US10874683, Example 56...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H13N3O6/c13-3-4-6(14)7(15)8(18-4)12-2-1-5(11-17)10-9(12)16/h1-2,4,6-8,13-15,17H,3H2,(H,10,11,16)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.50E+3n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476328
PNG
(US10874683, Example EIDD-02427-01)
Show SMILES CC(C)(C)C(=O)OCOP(=O)(OCOC(=O)C(C)(C)C)OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C(C)(F)[C@H]1O
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 5.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476329
PNG
(US10874683, Example EIDD-02207-01)
Show SMILES ONc1ccn([C@@H]2O[C@H](COP3(=O)OCc4ccccc4O3)[C@H](O)C2O)c(=O)n1
Show InChI InChI=1S/C16H18N3O9P/c20-13-11(8-26-29(24)25-7-9-3-1-2-4-10(9)28-29)27-15(14(13)21)19-6-5-12(18-23)17-16(19)22/h1-6,11,13-15,20-21,23H,7-8H2,(H,17,18,22)/t11-,13+,14?,15-,29?/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.08E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476330
PNG
(US10874683, Example EIDD-02108-03)
Show SMILES CCCCCCCCCCCCCCCCOCCCOP(O)(=O)OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C28H52N3O10P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-38-20-16-21-39-42(36,37)40-22-23-25(32)26(33)27(41-23)31-18-17-24(30-35)29-28(31)34/h17-18,23,25-27,32-33,35H,2-16,19-22H2,1H3,(H,36,37)(H,29,30,34)/t23-,25+,26?,27-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 3.45E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476331
PNG
(US10874683, Example EIDD-02503-01)
Show SMILES CCOP(=O)(OCC)OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C13H22N3O9P/c1-3-22-26(21,23-4-2)24-7-8-10(17)11(18)12(25-8)16-6-5-9(15-20)14-13(16)19/h5-6,8,10-12,17-18,20H,3-4,7H2,1-2H3,(H,14,15,19)/t8-,10+,11?,12-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476332
PNG
(US10874683, Example EIDD-02110-03)
Show SMILES CC(C)(C)C(=O)OCOP(=O)(OCOC(=O)C(C)(C)C)OC[C@]1(O[C@H](C(O)[C@H]1O)n1ccc(=O)[nH]c1=O)N=[N+]=[N-]
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 5.60E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476333
PNG
(US10874683, Example EIDD-01872-01)
Show SMILES CC1(O)[C@@H](O[C@@H]2COP(=O)(Oc3ccccc3)O[C@H]12)n1ccc(=O)[nH]c1=O
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476299
PNG
(US10874683, Example 00106 | US10874683, Example 56...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1O)n1ccc(NO)nc1=O
Show InChI InChI=1S/C9H13N3O6/c13-3-4-6(14)7(15)8(18-4)12-2-1-5(11-17)10-9(12)16/h1-2,4,6-8,13-15,17H,3H2,(H,10,11,16)/t4-,6+,7?,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>7.80E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair
Structural polyprotein


(CHIKV)
BDBM476303
PNG
(US10874683, Example 56.5 | US10874683, Example EID...)
Show SMILES CC1(O)[C@@H](O)[C@@H](CO)O[C@H]1n1ccc(NO)nc1=O
Show InChI InChI=1S/C10H15N3O6/c1-10(17)7(15)5(4-14)19-8(10)13-3-2-6(12-18)11-9(13)16/h2-3,5,7-8,14-15,17-18H,4H2,1H3,(H,11,12,16)/t5-,7+,8-,10?/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 7.20E+4n/an/an/an/a



Emory University

US Patent


Assay Description
Primary cytopathic effect (CPE) reduction assay. Four-concentration CPE inhibition assays are performed. Confluent or near-confluent cell culture mon...


US Patent US10874683 (2020)

More data for this
Ligand-Target Pair