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Patent code US10821115

Compile Data Set for Download or QSAR

Found 969 hits of Enzyme Inhibition Constant Data   
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
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471418
PNG
(US10821115, Example 100433)
Show SMILES C[C@H]1C\C=C\[C@](O)(C#CCC2CCOCC2)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C40H49ClN2O6S/c1-27-6-3-18-40(45,19-4-7-29-15-20-48-21-16-29)35-12-9-32(35)24-43-25-39(17-5-8-30-22-33(41)11-13-34(30)39)26-49-37-14-10-31(23-36(37)43)38(44)42-50(46,47)28(27)2/h3,10-11,13-14,18,22-23,27-29,32,35,45H,5-9,12,15-17,20-21,24-26H2,1-2H3,(H,42,44)/b18-3+/t27-,28+,32-,35+,39-,40-/m0/s1
PDB

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US Patent
n/an/a 0.0260n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471530
PNG
(US10821115, Example 100547)
Show SMILES CO[C@@]1(CC2=NC(C)(C)C(=O)O2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C39H48ClN3O7S/c1-24-8-6-17-39(48-5,20-34-41-37(3,4)36(45)50-34)31-13-10-28(31)21-43-22-38(16-7-9-26-18-29(40)12-14-30(26)38)23-49-33-15-11-27(19-32(33)43)35(44)42-51(46,47)25(24)2/h6,11-12,14-15,17-19,24-25,28,31H,7-10,13,16,20-23H2,1-5H3,(H,42,44)/b17-6+/t24-,25+,28-,31+,38-,39+/m0/s1
PDB

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US Patent
n/an/a 0.0310n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470886
PNG
((1S,3'R,6'R,7'S,8'E,11'S,12'R)- 6-chloro-7'-methox...)
Show SMILES CO[C@@]1(CN2CCN(CC2)[C@H]2CCOC(=O)C2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C43H57ClN4O7S/c1-29-6-4-16-43(53-3,27-46-17-19-47(20-18-46)35-14-21-54-40(49)24-35)37-11-8-33(37)25-48-26-42(15-5-7-31-22-34(44)10-12-36(31)42)28-55-39-13-9-32(23-38(39)48)41(50)45-56(51,52)30(29)2/h4,9-10,12-13,16,22-23,29-30,33,35,37H,5-8,11,14-15,17-21,24-28H2,1-3H3,(H,45,50)/b16-4+/t29-,30+,33-,35-,37+,42-,43+/m0/s1
PDB

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UniChem
US Patent
n/an/a 0.0310n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471007
PNG
(US10821115, Example 100020 | US10821115, Example 1...)
Show SMILES C[C@H]1C\C=C\[C@@](O)(CS(=O)(=O)N(C)C)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C35H46ClN3O7S2/c1-23-7-5-16-35(41,22-47(42,43)38(3)4)30-12-9-27(30)19-39-20-34(15-6-8-25-17-28(36)11-13-29(25)34)21-46-32-14-10-26(18-31(32)39)33(40)37-48(44,45)24(23)2/h5,10-11,13-14,16-18,23-24,27,30,41H,6-9,12,15,19-22H2,1-4H3,(H,37,40)/b16-5+/t23-,24+,27-,30+,34-,35+/m0/s1
PDB

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US Patent
n/an/a 0.0320n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471293
PNG
(US10821115, Example 100308 | US10821115, Example 1...)
Show SMILES C[C@H]1C\C=C\[C@@](O)(C#CCCN(C)C)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C38H48ClN3O5S/c1-26-9-7-19-38(44,18-5-6-20-41(3)4)33-14-11-30(33)23-42-24-37(17-8-10-28-21-31(39)13-15-32(28)37)25-47-35-16-12-29(22-34(35)42)36(43)40-48(45,46)27(26)2/h7,12-13,15-16,19,21-22,26-27,30,33,44H,6,8-11,14,17,20,23-25H2,1-4H3,(H,40,43)/b19-7+/t26-,27+,30-,33+,37-,38-/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0330n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470885
PNG
(US10821115, Example 270)
Show SMILES CO[C@@]1(CN2CCN(CC(O)=O)CC2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C40H53ClN4O7S/c1-27-6-4-15-40(51-3,25-44-18-16-43(17-19-44)23-37(46)47)34-11-8-31(34)22-45-24-39(14-5-7-29-20-32(41)10-12-33(29)39)26-52-36-13-9-30(21-35(36)45)38(48)42-53(49,50)28(27)2/h4,9-10,12-13,15,20-21,27-28,31,34H,5-8,11,14,16-19,22-26H2,1-3H3,(H,42,48)(H,46,47)/b15-4+/t27-,28+,31-,34+,39-,40+/m0/s1
PDB

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US Patent
n/an/a 0.0350n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471363
PNG
(US10821115, Example 100378)
Show SMILES COC[C@]1(O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C34H43ClN2O6S/c1-22-6-4-15-34(39,21-42-3)29-11-8-26(29)18-37-19-33(14-5-7-24-16-27(35)10-12-28(24)33)20-43-31-13-9-25(17-30(31)37)32(38)36-44(40,41)23(22)2/h4,9-10,12-13,15-17,22-23,26,29,39H,5-8,11,14,18-21H2,1-3H3,(H,36,38)/b15-4+/t22-,23+,26-,29+,33-,34+/m0/s1
PDB

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US Patent
n/an/a 0.0370n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470893
PNG
((3R)-3-(4- (((1S,3'R,6'R,7'S,8'E,11'S, 12'R)-6-ch...)
Show SMILES CO[C@@]1(CN2CCN(CC2)[C@H](CCO)CC(O)=O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C43H59ClN4O8S/c1-29-6-4-16-43(55-3,27-46-17-19-47(20-18-46)35(14-21-49)24-40(50)51)37-11-8-33(37)25-48-26-42(15-5-7-31-22-34(44)10-12-36(31)42)28-56-39-13-9-32(23-38(39)48)41(52)45-57(53,54)30(29)2/h4,9-10,12-13,16,22-23,29-30,33,35,37,49H,5-8,11,14-15,17-21,24-28H2,1-3H3,(H,45,52)(H,50,51)/b16-4+/t29-,30+,33-,35+,37+,42-,43+/m0/s1
PDB

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UniChem
US Patent
n/an/a 0.0390n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471004
PNG
(US10821115, Example 100017 | US10821115, Example 1...)
Show SMILES C[C@H]1C\C=C\[C@@](O)(C#CCCN2CCOCC2)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C40H50ClN3O6S/c1-28-7-5-17-40(46,16-3-4-18-43-19-21-49-22-20-43)35-12-9-32(35)25-44-26-39(15-6-8-30-23-33(41)11-13-34(30)39)27-50-37-14-10-31(24-36(37)44)38(45)42-51(47,48)29(28)2/h5,10-11,13-14,17,23-24,28-29,32,35,46H,4,6-9,12,15,18-22,25-27H2,1-2H3,(H,42,45)/b17-5+/t28-,29+,32-,35+,39-,40-/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0390n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471430
PNG
(US10821115, Example 100445)
Show SMILES COCCOC[C@@]1(O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C36H47ClN2O7S/c1-24-6-4-15-36(41,23-45-17-16-44-3)31-11-8-28(31)20-39-21-35(14-5-7-26-18-29(37)10-12-30(26)35)22-46-33-13-9-27(19-32(33)39)34(40)38-47(42,43)25(24)2/h4,9-10,12-13,15,18-19,24-25,28,31,41H,5-8,11,14,16-17,20-23H2,1-3H3,(H,38,40)/b15-4+/t24-,25+,28-,31+,35-,36-/m0/s1
PDB

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UniChem
US Patent
n/an/a 0.0400n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471543
PNG
(US10821115, Example 100560)
Show SMILES CO[C@@]1(Cc2cc(C)ccn2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C40H48ClN3O5S/c1-26-15-18-42-33(19-26)22-40(48-4)17-5-7-27(2)28(3)50(46,47)43-38(45)30-10-14-37-36(21-30)44(23-31-9-12-35(31)40)24-39(25-49-37)16-6-8-29-20-32(41)11-13-34(29)39/h5,10-11,13-15,17-21,27-28,31,35H,6-9,12,16,22-25H2,1-4H3,(H,43,45)/b17-5+/t27-,28+,31-,35+,39-,40+/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0410n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471422
PNG
(US10821115, Example 100437 | US10821115, Example 1...)
Show SMILES CO[C@@]1(C[C@H](O)C2CC2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C38H49ClN2O6S/c1-24-6-4-17-38(46-3,20-34(42)26-8-9-26)32-13-10-29(32)21-41-22-37(16-5-7-27-18-30(39)12-14-31(27)37)23-47-35-15-11-28(19-33(35)41)36(43)40-48(44,45)25(24)2/h4,11-12,14-15,17-19,24-26,29,32,34,42H,5-10,13,16,20-23H2,1-3H3,(H,40,43)/b17-4+/t24-,25+,29-,32+,34-,37-,38+/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0420n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471450
PNG
(US10821115, Example 100466)
Show SMILES COCCO[C@@]1(C)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C36H47ClN2O6S/c1-24-7-5-15-35(3,45-18-17-43-4)30-12-9-28(30)21-39-22-36(16-6-8-26-19-29(37)11-13-31(26)36)23-44-33-14-10-27(20-32(33)39)34(40)38-46(41,42)25(24)2/h5,10-11,13-15,19-20,24-25,28,30H,6-9,12,16-18,21-23H2,1-4H3,(H,38,40)/b15-5+/t24-,25+,28-,30+,35-,36-/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0430n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471416
PNG
(US10821115, Example 100431)
Show SMILES CO[C@@]1(CCN2CC(C)(C2)N(C)C)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C41H57ClN4O5S/c1-28-9-7-18-41(50-6,19-20-45-24-39(3,25-45)44(4)5)35-14-11-32(35)23-46-26-40(17-8-10-30-21-33(42)13-15-34(30)40)27-51-37-16-12-31(22-36(37)46)38(47)43-52(48,49)29(28)2/h7,12-13,15-16,18,21-22,28-29,32,35H,8-11,14,17,19-20,23-27H2,1-6H3,(H,43,47)/b18-7+/t28-,29+,32-,35+,40-,41+/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0430n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471560
PNG
(US10821115, Example 100577)
Show SMILES CO[C@@]1(CC(=O)NCc2ncco2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C39H47ClN4O7S/c1-25-6-4-15-39(49-3,20-35(45)42-21-36-41-16-17-50-36)32-11-8-29(32)22-44-23-38(14-5-7-27-18-30(40)10-12-31(27)38)24-51-34-13-9-28(19-33(34)44)37(46)43-52(47,48)26(25)2/h4,9-10,12-13,15-19,25-26,29,32H,5-8,11,14,20-24H2,1-3H3,(H,42,45)(H,43,46)/b15-4+/t25-,26+,29-,32+,38-,39+/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0450n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470777
PNG
((1S,3'R,6'R,7'S,8'E,10'S,11'S)- 6-chloro-7'-((9aS)...)
Show SMILES C[C@@H]1CS(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@H]4[C@](O)(CN4CCN5CCCC[C@@H]5C4)\C=C\[C@@H]1C)c3c2
Show InChI InChI=1S/C41H55ClN4O5S/c1-28-14-16-41(48,26-44-18-19-45-17-4-3-7-34(45)23-44)36-11-8-32(36)22-46-25-40(15-5-6-30-20-33(42)10-12-35(30)40)27-51-38-13-9-31(21-37(38)46)39(47)43-52(49,50)24-29(28)2/h9-10,12-14,16,20-21,28-29,32,34,36,48H,3-8,11,15,17-19,22-27H2,1-2H3,(H,43,47)/b16-14+/t28-,29+,32-,34+,36+,40-,41+/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0470n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471483
PNG
(US10821115, Example 100500)
Show SMILES CO[C@@]1(CC2=NCCO2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C37H46ClN3O6S/c1-24-6-4-15-37(45-3,20-34-39-16-17-46-34)31-11-8-28(31)21-41-22-36(14-5-7-26-18-29(38)10-12-30(26)36)23-47-33-13-9-27(19-32(33)41)35(42)40-48(43,44)25(24)2/h4,9-10,12-13,15,18-19,24-25,28,31H,5-8,11,14,16-17,20-23H2,1-3H3,(H,40,42)/b15-4+/t24-,25+,28-,31+,36-,37+/m0/s1
PDB

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n/an/a 0.0490n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471292
PNG
(US10821115, Example 100307)
Show SMILES CO[C@@]1(CC(O)=O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C35H43ClN2O7S/c1-22-6-4-15-35(44-3,18-32(39)40)29-11-8-26(29)19-38-20-34(14-5-7-24-16-27(36)10-12-28(24)34)21-45-31-13-9-25(17-30(31)38)33(41)37-46(42,43)23(22)2/h4,9-10,12-13,15-17,22-23,26,29H,5-8,11,14,18-21H2,1-3H3,(H,37,41)(H,39,40)/b15-4+/t22-,23+,26-,29+,34-,35+/m0/s1
PDB

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n/an/a 0.0490n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471432
PNG
(US10821115, Example 100447)
Show SMILES CO[C@@]1(CC=C(C)C)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C38H49ClN2O5S/c1-25(2)16-19-38(45-5)18-6-8-26(3)27(4)47(43,44)40-36(42)29-11-15-35-34(21-29)41(22-30-10-13-33(30)38)23-37(24-46-35)17-7-9-28-20-31(39)12-14-32(28)37/h6,11-12,14-16,18,20-21,26-27,30,33H,7-10,13,17,19,22-24H2,1-5H3,(H,40,42)/b18-6+/t26-,27+,30-,33+,37-,38+/m0/s1
PDB

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n/an/a 0.0500n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470833
PNG
((1S,3''R,6''R,7''R,8''E,11''S,12''R)- 7''-(((9aR)-...)
Show SMILES CO[C@]1(CN2CCN3CCN(C[C@@H]3C2)C(C)=O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C43H58ClN5O6S/c1-29-7-5-16-43(54-4,27-46-17-18-47-19-20-48(31(3)50)25-36(47)24-46)38-12-9-34(38)23-49-26-42(15-6-8-32-21-35(44)11-13-37(32)42)28-55-40-14-10-33(22-39(40)49)41(51)45-56(52,53)30(29)2/h5,10-11,13-14,16,21-22,29-30,34,36,38H,6-9,12,15,17-20,23-28H2,1-4H3,(H,45,51)/b16-5+/t29-,30+,34-,36-,38+,42-,43-/m0/s1
PDB

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n/an/a 0.0510n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470958
PNG
((1S,3'R,6'R,7'R,8'E,11'S,12'R)- 6-chloro-7'-(((3R,...)
Show SMILES CCN1[C@@H](C)CN(C[C@@]2(OC)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c3ccc4OC[C@]5(CCCc6cc(Cl)ccc56)CN(C[C@@H]5CC[C@@H]25)c4c3)C[C@H]1C
Show InChI InChI=1S/C42H59ClN4O5S/c1-7-47-29(3)22-45(23-30(47)4)26-42(51-6)19-8-10-28(2)31(5)53(49,50)44-40(48)33-13-17-39-38(21-33)46(24-34-12-15-37(34)42)25-41(27-52-39)18-9-11-32-20-35(43)14-16-36(32)41/h8,13-14,16-17,19-21,28-31,34,37H,7,9-12,15,18,22-27H2,1-6H3,(H,44,48)/b19-8+/t28-,29-,30+,31+,34-,37+,41-,42-/m0/s1
PDB

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n/an/a 0.0520n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470831
PNG
((1S,3''R,6''R,7''R,8''E,11''S,12''R)- 6-chloro-7''...)
Show SMILES CO[C@]1(CN2CCN3CCS(=O)(=O)C[C@@H]3C2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C41H55ClN4O7S2/c1-28-6-4-15-41(52-3,26-44-16-17-45-18-19-54(48,49)24-34(45)23-44)36-11-8-32(36)22-46-25-40(14-5-7-30-20-33(42)10-12-35(30)40)27-53-38-13-9-31(21-37(38)46)39(47)43-55(50,51)29(28)2/h4,9-10,12-13,15,20-21,28-29,32,34,36H,5-8,11,14,16-19,22-27H2,1-3H3,(H,43,47)/b15-4+/t28-,29+,32-,34-,36+,40-,41-/m0/s1
PDB

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n/an/a 0.0520n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470895
PNG
((1S,3'R,6'R,7'S,8'E,11'S,12'R)- 7'-((4-(1-acetyl-3...)
Show SMILES CO[C@@]1(CN2CCN(CC2)C2CN(C2)C(C)=O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C43H58ClN5O6S/c1-29-7-5-16-43(54-4,27-46-17-19-47(20-18-46)36-24-48(25-36)31(3)50)38-12-9-34(38)23-49-26-42(15-6-8-32-21-35(44)11-13-37(32)42)28-55-40-14-10-33(22-39(40)49)41(51)45-56(52,53)30(29)2/h5,10-11,13-14,16,21-22,29-30,34,36,38H,6-9,12,15,17-20,23-28H2,1-4H3,(H,45,51)/b16-5+/t29-,30+,34-,38+,42-,43+/m0/s1
PDB

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n/an/a 0.0520n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471515
PNG
(US10821115, Example 100532)
Show SMILES C[C@H]1C\C=C\[C@](O)(Cc2cc(C)ccn2)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C39H46ClN3O5S/c1-25-14-17-41-32(18-25)21-39(45)16-4-6-26(2)27(3)49(46,47)42-37(44)29-9-13-36-35(20-29)43(22-30-8-11-34(30)39)23-38(24-48-36)15-5-7-28-19-31(40)10-12-33(28)38/h4,9-10,12-14,16-20,26-27,30,34,45H,5-8,11,15,21-24H2,1-3H3,(H,42,44)/b16-4+/t26-,27+,30-,34+,38-,39-/m0/s1
PDB

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n/an/a 0.0530n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470604
PNG
((1 S,3′R,6′R,7′R,8′E, 11&#...)
Show SMILES CO[C@]1(CN2CCN(C(C)C)[C@H](C)C2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C42H59ClN4O5S/c1-28(2)47-20-19-45(23-30(47)4)26-42(51-6)18-7-9-29(3)31(5)53(49,50)44-40(48)33-12-16-39-38(22-33)46(24-34-11-14-37(34)42)25-41(27-52-39)17-8-10-32-21-35(43)13-15-36(32)41/h7,12-13,15-16,18,21-22,28-31,34,37H,8-11,14,17,19-20,23-27H2,1-6H3,(H,44,48)/b18-7+/t29-,30+,31+,34-,37+,41-,42-/m0/s1
PDB

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n/an/a 0.0530n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471420
PNG
(US10821115, Example 100435 | US10821115, Example 1...)
Show SMILES CO[C@@]1(C[C@@H](C)O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C36H47ClN2O6S/c1-23-7-5-16-36(44-4,19-24(2)40)31-12-9-28(31)20-39-21-35(15-6-8-26-17-29(37)11-13-30(26)35)22-45-33-14-10-27(18-32(33)39)34(41)38-46(42,43)25(23)3/h5,10-11,13-14,16-18,23-25,28,31,40H,6-9,12,15,19-22H2,1-4H3,(H,38,41)/b16-5+/t23-,24+,25+,28-,31+,35-,36+/m0/s1
PDB

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n/an/a 0.0550n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470988
PNG
(US10821115, Example 100001 | US10821115, Example 1...)
Show SMILES CO[C@]1(\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2)C1SCCCS1
Show InChI InChI=1S/C37H47ClN2O5S3/c1-24-7-4-16-37(44-3,35-46-17-6-18-47-35)31-12-9-28(31)21-40-22-36(15-5-8-26-19-29(38)11-13-30(26)36)23-45-33-14-10-27(20-32(33)40)34(41)39-48(42,43)25(24)2/h4,10-11,13-14,16,19-20,24-25,28,31,35H,5-9,12,15,17-18,21-23H2,1-3H3,(H,39,41)/b16-4+/t24-,25+,28-,31+,36-,37-/m0/s1
PDB

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n/an/a 0.0550n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471107
PNG
(US10821115, Example 100120 | US10821115, Example 1...)
Show SMILES C[C@@H](C(O)=O)[C@@]1(O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C35H43ClN2O7S/c1-21-6-4-15-35(42,22(2)33(40)41)29-11-8-26(29)18-38-19-34(14-5-7-24-16-27(36)10-12-28(24)34)20-45-31-13-9-25(17-30(31)38)32(39)37-46(43,44)23(21)3/h4,9-10,12-13,15-17,21-23,26,29,42H,5-8,11,14,18-20H2,1-3H3,(H,37,39)(H,40,41)/b15-4+/t21-,22-,23+,26-,29+,34-,35-/m0/s1
PDB

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n/an/a 0.0560n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471379
PNG
(US10821115, Example 100394 | US10821115, Example 1...)
Show SMILES C[C@H]1C\C=C\[C@@](O)(C#CCO)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C35H41ClN2O6S/c1-23-6-3-15-35(41,16-5-17-39)30-11-8-27(30)20-38-21-34(14-4-7-25-18-28(36)10-12-29(25)34)22-44-32-13-9-26(19-31(32)38)33(40)37-45(42,43)24(23)2/h3,9-10,12-13,15,18-19,23-24,27,30,39,41H,4,6-8,11,14,17,20-22H2,1-2H3,(H,37,40)/b15-3+/t23-,24+,27-,30+,34-,35+/m0/s1
PDB

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n/an/a 0.0560n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471408
PNG
(US10821115, Example 100423)
Show SMILES COCCC#C[C@]1(OC)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C38H47ClN2O6S/c1-26-9-7-19-38(46-4,18-5-6-20-45-3)33-14-11-30(33)23-41-24-37(17-8-10-28-21-31(39)13-15-32(28)37)25-47-35-16-12-29(22-34(35)41)36(42)40-48(43,44)27(26)2/h7,12-13,15-16,19,21-22,26-27,30,33H,6,8-11,14,17,20,23-25H2,1-4H3,(H,40,42)/b19-7+/t26-,27+,30-,33+,37-,38-/m0/s1
PDB

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n/an/a 0.0560n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471492
PNG
(US10821115, Example 100509)
Show SMILES CO[C@@]1(CC(=O)NCCCl)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C37H47Cl2N3O6S/c1-24-6-4-15-37(47-3,20-34(43)40-17-16-38)31-11-8-28(31)21-42-22-36(14-5-7-26-18-29(39)10-12-30(26)36)23-48-33-13-9-27(19-32(33)42)35(44)41-49(45,46)25(24)2/h4,9-10,12-13,15,18-19,24-25,28,31H,5-8,11,14,16-17,20-23H2,1-3H3,(H,40,43)(H,41,44)/b15-4+/t24-,25+,28-,31+,36-,37+/m0/s1
PDB

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n/an/a 0.0570n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471415
PNG
(US10821115, Example 100430)
Show SMILES CO[C@@]1(CCN2CCN(C)C(=O)C2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C40H53ClN4O6S/c1-27-7-5-16-40(50-4,17-18-44-20-19-43(3)37(46)24-44)34-12-9-31(34)23-45-25-39(15-6-8-29-21-32(41)11-13-33(29)39)26-51-36-14-10-30(22-35(36)45)38(47)42-52(48,49)28(27)2/h5,10-11,13-14,16,21-22,27-28,31,34H,6-9,12,15,17-20,23-26H2,1-4H3,(H,42,47)/b16-5+/t27-,28+,31-,34+,39-,40+/m0/s1
PDB

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n/an/a 0.0570n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471528
PNG
(US10821115, Example 100545 | US10821115, Example 1...)
Show SMILES CO[C@@]1(CC(=O)N[C@H]2CCOC2=O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C39H48ClN3O8S/c1-24-6-4-16-39(49-3,20-35(44)41-32-14-17-50-37(32)46)31-11-8-28(31)21-43-22-38(15-5-7-26-18-29(40)10-12-30(26)38)23-51-34-13-9-27(19-33(34)43)36(45)42-52(47,48)25(24)2/h4,9-10,12-13,16,18-19,24-25,28,31-32H,5-8,11,14-15,17,20-23H2,1-3H3,(H,41,44)(H,42,45)/b16-4+/t24-,25+,28-,31+,32-,38-,39+/m0/s1
PDB

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n/an/a 0.0570n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471568
PNG
(US10821115, Example 100585)
Show SMILES COCc1nc(C[C@]2(OC)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c3ccc4OC[C@]5(CCCc6cc(Cl)ccc56)CN(C[C@@H]5CC[C@@H]25)c4c3)oc1C
Show InChI InChI=1S/C40H50ClN3O7S/c1-25-8-6-17-40(49-5,20-37-42-34(22-48-4)26(2)51-37)33-13-10-30(33)21-44-23-39(16-7-9-28-18-31(41)12-14-32(28)39)24-50-36-15-11-29(19-35(36)44)38(45)43-52(46,47)27(25)3/h6,11-12,14-15,17-19,25,27,30,33H,7-10,13,16,20-24H2,1-5H3,(H,43,45)/b17-6+/t25-,27+,30-,33+,39-,40+/m0/s1
PDB

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n/an/a 0.0570n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470828
PNG
((1S,3''R,6''R,7''S,8''E,11''S,12''R)- 7''-(((9aS)-...)
Show SMILES CO[C@@]1(CN2CCN3CCN(C[C@@H]3C2)C(C)=O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C43H58ClN5O6S/c1-29-7-5-16-43(54-4,27-46-17-18-47-19-20-48(31(3)50)25-36(47)24-46)38-12-9-34(38)23-49-26-42(15-6-8-32-21-35(44)11-13-37(32)42)28-55-40-14-10-33(22-39(40)49)41(51)45-56(52,53)30(29)2/h5,10-11,13-14,16,21-22,29-30,34,36,38H,6-9,12,15,17-20,23-28H2,1-4H3,(H,45,51)/b16-5+/t29-,30+,34-,36-,38+,42-,43+/m0/s1
PDB

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n/an/a 0.0570n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470849
PNG
((1S,3''R,6''R,7''S,8''E,11''S,12''R)- 7''-(((9aR)-...)
Show SMILES CO[C@@]1(CN2CCN3CCN(C[C@@H]3C2)C(=O)C=C)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C44H58ClN5O6S/c1-5-41(51)49-21-20-48-19-18-47(25-36(48)26-49)28-44(55-4)17-6-8-30(2)31(3)57(53,54)46-42(52)33-11-15-40-39(23-33)50(24-34-10-13-38(34)44)27-43(29-56-40)16-7-9-32-22-35(45)12-14-37(32)43/h5-6,11-12,14-15,17,22-23,30-31,34,36,38H,1,7-10,13,16,18-21,24-29H2,2-4H3,(H,46,52)/b17-6+/t30-,31+,34-,36-,38+,43-,44+/m0/s1
PDB

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n/an/a 0.0580n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470603
PNG
(US10821115, Example 7)
Show SMILES C[C@H]1CCC[C@@](O)(CN2CCN3CCOC[C@@H]3C2)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C40H55ClN4O6S/c1-27-5-3-14-40(47,25-43-15-16-44-17-18-50-23-33(44)22-43)35-10-7-31(35)21-45-24-39(13-4-6-29-19-32(41)9-11-34(29)39)26-51-37-12-8-30(20-36(37)45)38(46)42-52(48,49)28(27)2/h8-9,11-12,19-20,27-28,31,33,35,47H,3-7,10,13-18,21-26H2,1-2H3,(H,42,46)/t27-,28+,31-,33-,35+,39-,40+/m0/s1
PDB

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n/an/a 0.0580n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470816
PNG
((1S,3'R,6'R,7'S,8'E,11'S,12'R)- 6-chloro-7'-((2,2-...)
Show SMILES CO[C@@]1(CN2CC3(C2)CS(=O)(=O)C3)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C39H50ClN3O7S2/c1-26-6-4-15-39(49-3,22-42-19-37(20-42)24-51(45,46)25-37)33-11-8-30(33)18-43-21-38(14-5-7-28-16-31(40)10-12-32(28)38)23-50-35-13-9-29(17-34(35)43)36(44)41-52(47,48)27(26)2/h4,9-10,12-13,15-17,26-27,30,33H,5-8,11,14,18-25H2,1-3H3,(H,41,44)/b15-4+/t26-,27+,30-,33+,38-,39+/m0/s1
PDB

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n/an/a 0.0580n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471533
PNG
(US10821115, Example 100550)
Show SMILES COC(=O)CNC(=O)C[C@]1(OC)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C38H48ClN3O8S/c1-24-7-5-16-38(49-4,19-34(43)40-20-35(44)48-3)31-12-9-28(31)21-42-22-37(15-6-8-26-17-29(39)11-13-30(26)37)23-50-33-14-10-27(18-32(33)42)36(45)41-51(46,47)25(24)2/h5,10-11,13-14,16-18,24-25,28,31H,6-9,12,15,19-23H2,1-4H3,(H,40,43)(H,41,45)/b16-5+/t24-,25+,28-,31+,37-,38+/m0/s1
PDB

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n/an/a 0.0590n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471364
PNG
(US10821115, Example 100379)
Show SMILES CO[C@@]1(\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2)c1cnccn1
Show InChI InChI=1S/C37H43ClN4O5S/c1-24-6-4-15-37(46-3,34-20-39-16-17-40-34)31-11-8-28(31)21-42-22-36(14-5-7-26-18-29(38)10-12-30(26)36)23-47-33-13-9-27(19-32(33)42)35(43)41-48(44,45)25(24)2/h4,9-10,12-13,15-20,24-25,28,31H,5-8,11,14,21-23H2,1-3H3,(H,41,43)/b15-4+/t24-,25+,28-,31+,36-,37+/m0/s1
PDB

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n/an/a 0.0600n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470614
PNG
(US10821115, Example 18)
Show SMILES COC(=O)c1ccc(OC[C@@]2(CNC[C@@H]3CC[C@H]3COC(C)=O)CCCc3cc(Cl)ccc23)c(Br)n1
Show InChI InChI=1S/C27H32BrClN2O5/c1-17(32)35-14-20-6-5-19(20)13-30-15-27(11-3-4-18-12-21(29)7-8-22(18)27)16-36-24-10-9-23(26(33)34-2)31-25(24)28/h7-10,12,19-20,30H,3-6,11,13-16H2,1-2H3/t19-,20-,27-/m0/s1
PDB

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n/an/a 0.0600n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471005
PNG
(US10821115, Example 100018 | US10821115, Example 1...)
Show SMILES C[C@H]1C\C=C\[C@@](O)(C#CCN2CCOCC2)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C39H48ClN3O6S/c1-27-6-3-15-39(45,16-5-17-42-18-20-48-21-19-42)34-11-8-31(34)24-43-25-38(14-4-7-29-22-32(40)10-12-33(29)38)26-49-36-13-9-30(23-35(36)43)37(44)41-50(46,47)28(27)2/h3,9-10,12-13,15,22-23,27-28,31,34,45H,4,6-8,11,14,17-21,24-26H2,1-2H3,(H,41,44)/b15-3+/t27-,28+,31-,34+,38-,39+/m0/s1
PDB

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n/an/a 0.0610n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470979
PNG
((1S,3′R,6′R,7′R,8′E,11R...)
Show SMILES CO[C@]1(CN2CCN3CCCC[C@@H]3C2)\C=C\C[C@H](C)[C@@H](C[C@@H](C)O)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C44H61ClN4O6S/c1-30-8-6-18-44(54-3,28-47-20-21-48-19-5-4-10-36(48)26-47)38-14-11-34(38)25-49-27-43(17-7-9-32-23-35(45)13-15-37(32)43)29-55-40-16-12-33(24-39(40)49)42(51)46-56(52,53)41(30)22-31(2)50/h6,12-13,15-16,18,23-24,30-31,34,36,38,41,50H,4-5,7-11,14,17,19-22,25-29H2,1-3H3,(H,46,51)/b18-6+/t30-,31+,34-,36+,38+,41+,43-,44-/m0/s1
PDB

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n/an/a 0.0610n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470846
PNG
((1S,3''R,6''R,7''S,8''E,11''S,12''R)- 6-chloro-7''...)
Show SMILES CO[C@@]1(CN2CCN3CCS(=O)(=O)C[C@@H]3C2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C41H55ClN4O7S2/c1-28-6-4-15-41(52-3,26-44-16-17-45-18-19-54(48,49)24-34(45)23-44)36-11-8-32(36)22-46-25-40(14-5-7-30-20-33(42)10-12-35(30)40)27-53-38-13-9-31(21-37(38)46)39(47)43-55(50,51)29(28)2/h4,9-10,12-13,15,20-21,28-29,32,34,36H,5-8,11,14,16-19,22-27H2,1-3H3,(H,43,47)/b15-4+/t28-,29+,32-,34-,36+,40-,41+/m0/s1
PDB

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n/an/a 0.0610n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470963
PNG
((1S,3'R,6'R,7'S,8'E,11'S,12'R)- 6-chloro-7'-((9aS)...)
Show SMILES CO[C@@]1(CN2CCN3CCOC[C@@H]3C2)\C=C\C[C@H](C)[C@@H](CCO)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C42H57ClN4O7S/c1-29-5-3-15-42(52-2,27-45-16-17-46-18-20-53-25-34(46)24-45)36-10-7-32(36)23-47-26-41(14-4-6-30-21-33(43)9-11-35(30)41)28-54-38-12-8-31(22-37(38)47)40(49)44-55(50,51)39(29)13-19-48/h3,8-9,11-12,15,21-22,29,32,34,36,39,48H,4-7,10,13-14,16-20,23-28H2,1-2H3,(H,44,49)/b15-3+/t29-,32-,34-,36+,39+,41-,42+/m0/s1
PDB

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n/an/a 0.0620n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471088
PNG
(US10821115, Example 100101)
Show SMILES C[C@H]1C\C=C\[C@](C)(O)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)NS(=O)(=O)[C@@H]1C
Show InChI InChI=1S/C33H41ClN2O5S/c1-21-6-4-14-32(3,38)27-11-8-25(27)18-36-19-33(15-5-7-23-16-26(34)10-12-28(23)33)20-41-30-13-9-24(17-29(30)36)31(37)35-42(39,40)22(21)2/h4,9-10,12-14,16-17,21-22,25,27,38H,5-8,11,15,18-20H2,1-3H3,(H,35,37)/b14-4+/t21-,22+,25-,27+,32-,33-/m0/s1
PDB

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n/an/a 0.0620n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM470864
PNG
((1S,3'R,6'R,7'S,8'E,11'S,12'R)- 7'-((4-acetyl-1- p...)
Show SMILES CO[C@@]1(CN2CCN(CC2)C(C)=O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C40H53ClN4O6S/c1-27-7-5-16-40(50-4,25-43-17-19-44(20-18-43)29(3)46)35-12-9-32(35)23-45-24-39(15-6-8-30-21-33(41)11-13-34(30)39)26-51-37-14-10-31(22-36(37)45)38(47)42-52(48,49)28(27)2/h5,10-11,13-14,16,21-22,27-28,32,35H,6-9,12,15,17-20,23-26H2,1-4H3,(H,42,47)/b16-5+/t27-,28+,32-,35+,39-,40+/m0/s1
PDB

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n/an/a 0.0630n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471531
PNG
(US10821115, Example 100548)
Show SMILES CO[C@]1(Cc2cc(C)on2)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C38H46ClN3O6S/c1-24-7-5-16-38(46-4,20-31-17-25(2)48-40-31)33-12-9-29(33)21-42-22-37(15-6-8-27-18-30(39)11-13-32(27)37)23-47-35-14-10-28(19-34(35)42)36(43)41-49(44,45)26(24)3/h5,10-11,13-14,16-19,24,26,29,33H,6-9,12,15,20-23H2,1-4H3,(H,41,43)/b16-5+/t24-,26+,29-,33+,37-,38-/m0/s1
PDB

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n/an/a 0.0640n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471480
PNG
(US10821115, Example 100497)
Show SMILES CO[C@]1(\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2)c1nccs1
Show InChI InChI=1S/C36H42ClN3O5S2/c1-23-6-4-15-36(44-3,34-38-16-17-46-34)30-11-8-27(30)20-40-21-35(14-5-7-25-18-28(37)10-12-29(25)35)22-45-32-13-9-26(19-31(32)40)33(41)39-47(42,43)24(23)2/h4,9-10,12-13,15-19,23-24,27,30H,5-8,11,14,20-22H2,1-3H3,(H,39,41)/b15-4+/t23-,24+,27-,30+,35-,36-/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0640n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (171-327)


(Homo sapiens (Human))
BDBM471546
PNG
(US10821115, Example 100563)
Show SMILES CO[C@@]1(CC(=O)NCC(C)C(F)(F)F)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2
Show InChI InChI=1S/C39H49ClF3N3O6S/c1-24-7-5-16-38(51-4,19-35(47)44-20-25(2)39(41,42)43)32-12-9-29(32)21-46-22-37(15-6-8-27-17-30(40)11-13-31(27)37)23-52-34-14-10-28(18-33(34)46)36(48)45-53(49,50)26(24)3/h5,10-11,13-14,16-18,24-26,29,32H,6-9,12,15,19-23H2,1-4H3,(H,44,47)(H,45,48)/b16-5+/t24-,25?,26+,29-,32+,37-,38+/m0/s1
PDB

GoogleScholar
UniChem
US Patent
n/an/a 0.0650n/an/an/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...


US Patent US10821115 (2020)

More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%