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Compile Data Set for Download or QSAR

Found 48 hits Enz. Inhib. hit(s) with all data for entry = 50018416   
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
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50303503
PNG
(CHEMBL4160782 | US10858316, Compound SF-5-141)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N2CC(Cc3ccccc23)C(O)=O)cc(C)c1Cl
Show InChI InChI=1S/C24H22ClNO5S/c1-15-11-20(12-16(2)23(15)25)31-19-7-9-21(10-8-19)32(29,30)26-14-18(24(27)28)13-17-5-3-4-6-22(17)26/h3-12,18H,13-14H2,1-2H3,(H,27,28)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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UniChem

Similars

120n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473880
PNG
(5-(4-(4-chloro-3,5- dimethylphenoxy)- N-isobutylph...)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccc(Oc2cc(C)c(Cl)c(C)c2)cc1
Show InChI InChI=1S/C25H26ClNO6S/c1-15(2)14-27(18-5-10-23(28)22(13-18)25(29)30)34(31,32)21-8-6-19(7-9-21)33-20-11-16(3)24(26)17(4)12-20/h5-13,15,28H,14H2,1-4H3,(H,29,30)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
586n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473868
PNG
(4-(N-benzyl-4-(4- chloro-3,5- dimethylphenoxy) phe...)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N(Cc2ccccc2)c2ccc(C(O)=O)c(O)c2)cc(C)c1Cl
Show InChI InChI=1S/C28H24ClNO6S/c1-18-14-23(15-19(2)27(18)29)36-22-9-11-24(12-10-22)37(34,35)30(17-20-6-4-3-5-7-20)21-8-13-25(28(32)33)26(31)16-21/h3-16,31H,17H2,1-2H3,(H,32,33)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
629n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473862
PNG
(3-(4-(4-chloro-3,5- dimethylphenoxy)- N- isobutylp...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Oc2cc(C)c(Cl)c(C)c2)cc1
Show InChI InChI=1S/C25H26ClNO6S/c1-15(2)14-27(18-5-10-22(25(29)30)23(28)13-18)34(31,32)21-8-6-19(7-9-21)33-20-11-16(3)24(26)17(4)12-20/h5-13,15,28H,14H2,1-4H3,(H,29,30)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
778n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473876
PNG
(3-(4-(4-chloro-3,5- dimethylphenoxy)- N-isobutylph...)
Show SMILES CC(C)CN(c1cccc(c1)C(O)=O)S(=O)(=O)c1ccc(Oc2cc(C)c(Cl)c(C)c2)cc1
Show InChI InChI=1S/C25H26ClNO5S/c1-16(2)15-27(20-7-5-6-19(14-20)25(28)29)33(30,31)23-10-8-21(9-11-23)32-22-12-17(3)24(26)18(4)13-22/h5-14,16H,15H2,1-4H3,(H,28,29)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
1.45E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473862
PNG
(3-(4-(4-chloro-3,5- dimethylphenoxy)- N- isobutylp...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Oc2cc(C)c(Cl)c(C)c2)cc1
Show InChI InChI=1S/C25H26ClNO6S/c1-15(2)14-27(18-5-10-22(25(29)30)23(28)13-18)34(31,32)21-8-6-19(7-9-21)33-20-11-16(3)24(26)17(4)12-20/h5-13,15,28H,14H2,1-4H3,(H,29,30)
PDB
MMDB

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PC sid
UniChem
1.63E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473868
PNG
(4-(N-benzyl-4-(4- chloro-3,5- dimethylphenoxy) phe...)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N(Cc2ccccc2)c2ccc(C(O)=O)c(O)c2)cc(C)c1Cl
Show InChI InChI=1S/C28H24ClNO6S/c1-18-14-23(15-19(2)27(18)29)36-22-9-11-24(12-10-22)37(34,35)30(17-20-6-4-3-5-7-20)21-8-13-25(28(32)33)26(31)16-21/h3-16,31H,17H2,1-2H3,(H,32,33)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
1.67E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473867
PNG
(4-(N-benzyl-[1,1'- biphenyl]-4- ylsulfonamido)-2- ...)
Show SMILES OC(=O)c1ccc(cc1O)N(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H21NO5S/c28-25-17-22(13-16-24(25)26(29)30)27(18-19-7-3-1-4-8-19)33(31,32)23-14-11-21(12-15-23)20-9-5-2-6-10-20/h1-17,28H,18H2,(H,29,30)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
1.71E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50608153
PNG
(CHEMBL5269202)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N(C2CCCC2)c2ccc(C(O)=O)c(O)c2)cc(C)c1Cl
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
1.76E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM50608153
PNG
(CHEMBL5269202)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N(C2CCCC2)c2ccc(C(O)=O)c(O)c2)cc(C)c1Cl
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
1.91E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473849
PNG
(4-(4-(4-chloro-3,5- dimethylphenoxy)- N-isobutylph...)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)=O)S(=O)(=O)c1ccc(Oc2cc(C)c(Cl)c(C)c2)cc1
Show InChI InChI=1S/C25H26ClNO5S/c1-16(2)15-27(20-7-5-19(6-8-20)25(28)29)33(30,31)23-11-9-21(10-12-23)32-22-13-17(3)24(26)18(4)14-22/h5-14,16H,15H2,1-4H3,(H,28,29)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
2.06E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473859
PNG
(2-hydroxy-4-(N- isobutyl-4-(p- tolyloxy)phenyl- su...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Oc2ccc(C)cc2)cc1
Show InChI InChI=1S/C24H25NO6S/c1-16(2)15-25(18-6-13-22(24(27)28)23(26)14-18)32(29,30)21-11-9-20(10-12-21)31-19-7-4-17(3)5-8-19/h4-14,16,26H,15H2,1-3H3,(H,27,28)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
2.26E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473844
PNG
(1-((4-(4-chloro-3,5- dimethylphenoxy) phenyl) sulf...)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N2CCCc3cc(ccc23)C(O)=O)cc(C)c1Cl
Show InChI InChI=1S/C24H22ClNO5S/c1-15-12-20(13-16(2)23(15)25)31-19-6-8-21(9-7-19)32(29,30)26-11-3-4-17-14-18(24(27)28)5-10-22(17)26/h5-10,12-14H,3-4,11H2,1-2H3,(H,27,28)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
2.73E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473861
PNG
(4-(4-(2,4- dichlorophenoxy)- N-isobutylphenyl- sul...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1
Show InChI InChI=1S/C23H21Cl2NO6S/c1-14(2)13-26(16-4-9-19(23(28)29)21(27)12-16)33(30,31)18-7-5-17(6-8-18)32-22-10-3-15(24)11-20(22)25/h3-12,14,27H,13H2,1-2H3,(H,28,29)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
2.74E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473880
PNG
(5-(4-(4-chloro-3,5- dimethylphenoxy)- N-isobutylph...)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccc(Oc2cc(C)c(Cl)c(C)c2)cc1
Show InChI InChI=1S/C25H26ClNO6S/c1-15(2)14-27(18-5-10-23(28)22(13-18)25(29)30)34(31,32)21-8-6-19(7-9-21)33-20-11-16(3)24(26)17(4)12-20/h5-13,15,28H,14H2,1-4H3,(H,29,30)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
2.91E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473860
PNG
(4-(4-(3,5- dimethylphenoxy)- N-isobutylphenyl- sul...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Oc2cc(C)cc(C)c2)cc1
Show InChI InChI=1S/C25H27NO6S/c1-16(2)15-26(19-5-10-23(25(28)29)24(27)14-19)33(30,31)22-8-6-20(7-9-22)32-21-12-17(3)11-18(4)13-21/h5-14,16,27H,15H2,1-4H3,(H,28,29)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
2.96E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473844
PNG
(1-((4-(4-chloro-3,5- dimethylphenoxy) phenyl) sulf...)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N2CCCc3cc(ccc23)C(O)=O)cc(C)c1Cl
Show InChI InChI=1S/C24H22ClNO5S/c1-15-12-20(13-16(2)23(15)25)31-19-6-8-21(9-7-19)32(29,30)26-11-3-4-17-14-18(24(27)28)5-10-22(17)26/h5-10,12-14H,3-4,11H2,1-2H3,(H,27,28)
PDB
MMDB

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Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
3.56E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473852
PNG
(2-hydroxy-4-(N- isobutyl-[1,1'- biphenyl]-4- ylsul...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C23H23NO5S/c1-16(2)15-24(19-10-13-21(23(26)27)22(25)14-19)30(28,29)20-11-8-18(9-12-20)17-6-4-3-5-7-17/h3-14,16,25H,15H2,1-2H3,(H,26,27)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
4.11E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM50303503
PNG
(CHEMBL4160782 | US10858316, Compound SF-5-141)
Show SMILES Cc1cc(Oc2ccc(cc2)S(=O)(=O)N2CC(Cc3ccccc23)C(O)=O)cc(C)c1Cl
Show InChI InChI=1S/C24H22ClNO5S/c1-15-11-20(12-16(2)23(15)25)31-19-7-9-21(10-8-19)32(29,30)26-14-18(24(27)28)13-17-5-3-4-6-22(17)26/h3-12,18H,13-14H2,1-2H3,(H,27,28)
PDB
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UniChem

Similars

5.01E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473864
PNG
(4-(N-cyclopentyl- [1,1'- biphenyl]-4- ylsulfonamid...)
Show SMILES OC(=O)c1ccc(cc1O)N(C1CCCC1)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C24H23NO5S/c26-23-16-20(12-15-22(23)24(27)28)25(19-8-4-5-9-19)31(29,30)21-13-10-18(11-14-21)17-6-2-1-3-7-17/h1-3,6-7,10-16,19,26H,4-5,8-9H2,(H,27,28)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
5.24E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473858
PNG
(2-hydroxy-4-(N- isobutyl-4- phenoxyphenyl- sulfona...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C23H23NO6S/c1-16(2)15-24(17-8-13-21(23(26)27)22(25)14-17)31(28,29)20-11-9-19(10-12-20)30-18-6-4-3-5-7-18/h3-14,16,25H,15H2,1-2H3,(H,26,27)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
5.77E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473878
PNG
(US10858316, Compound jy-5-299)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H21NO5S/c1-14(2)13-22(17-8-10-20(23)19(12-17)21(24)25)28(26,27)18-9-7-15-5-3-4-6-16(15)11-18/h3-12,14,23H,13H2,1-2H3,(H,24,25)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
7.51E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473879
PNG
(2-hydroxy-5-(N- isobutyl-[1,1'- biphenyl]-4- ylsul...)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C23H23NO5S/c1-16(2)15-24(19-10-13-22(25)21(14-19)23(26)27)30(28,29)20-11-8-18(9-12-20)17-6-4-3-5-7-17/h3-14,16,25H,15H2,1-2H3,(H,26,27)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
8.70E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473852
PNG
(2-hydroxy-4-(N- isobutyl-[1,1'- biphenyl]-4- ylsul...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C23H23NO5S/c1-16(2)15-24(19-10-13-21(23(26)27)22(25)14-19)30(28,29)20-11-8-18(9-12-20)17-6-4-3-5-7-17/h3-14,16,25H,15H2,1-2H3,(H,26,27)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473866
PNG
(4-(N- benzyl- naphthalene-2- sulfonamido)-2- hydro...)
Show SMILES OC(=O)c1ccc(cc1O)N(Cc1ccccc1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H19NO5S/c26-23-15-20(11-13-22(23)24(27)28)25(16-17-6-2-1-3-7-17)31(29,30)21-12-10-18-8-4-5-9-19(18)14-21/h1-15,26H,16H2,(H,27,28)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473869
PNG
(2-hydroxy-4-(4- phenoxyphenyl- sulfonamido) benzoi...)
Show SMILES OC(=O)c1ccc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)cc1O
Show InChI InChI=1S/C19H15NO6S/c21-18-12-13(6-11-17(18)19(22)23)20-27(24,25)16-9-7-15(8-10-16)26-14-4-2-1-3-5-14/h1-12,20-21H,(H,22,23)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473851
PNG
(2-hydroxy-4-(N- isobutylnaphthalene- 2-sulfonamido...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H21NO5S/c1-14(2)13-22(17-8-10-19(21(24)25)20(23)12-17)28(26,27)18-9-7-15-5-3-4-6-16(15)11-18/h3-12,14,23H,13H2,1-2H3,(H,24,25)
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Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473879
PNG
(2-hydroxy-5-(N- isobutyl-[1,1'- biphenyl]-4- ylsul...)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C23H23NO5S/c1-16(2)15-24(19-10-13-22(25)21(14-19)23(26)27)30(28,29)20-11-8-18(9-12-20)17-6-4-3-5-7-17/h3-14,16,25H,15H2,1-2H3,(H,26,27)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473847
PNG
(4-(N-isobutyl-[1,1'- biphenyl]-4- ylsulfonamido) b...)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C23H23NO4S/c1-17(2)16-24(21-12-8-20(9-13-21)23(25)26)29(27,28)22-14-10-19(11-15-22)18-6-4-3-5-7-18/h3-15,17H,16H2,1-2H3,(H,25,26)
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Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473854
PNG
(4-(4-bromo-N- isobutylphenyl- sulfonamido)-2- hydr...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C17H18BrNO5S/c1-11(2)10-19(13-5-8-15(17(21)22)16(20)9-13)25(23,24)14-6-3-12(18)4-7-14/h3-9,11,20H,10H2,1-2H3,(H,21,22)
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Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473858
PNG
(2-hydroxy-4-(N- isobutyl-4- phenoxyphenyl- sulfona...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C23H23NO6S/c1-16(2)15-24(17-8-13-21(23(26)27)22(25)14-17)31(28,29)20-11-9-19(10-12-20)30-18-6-4-3-5-7-18/h3-14,16,25H,15H2,1-2H3,(H,26,27)
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Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473863
PNG
(4-(N- cyclopentyl- naphthalene- 2-sulfonamido)-2- ...)
Show SMILES OC(=O)c1ccc(cc1O)N(C1CCCC1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H21NO5S/c24-21-14-18(10-12-20(21)22(25)26)23(17-7-3-4-8-17)29(27,28)19-11-9-15-5-1-2-6-16(15)13-19/h1-2,5-6,9-14,17,24H,3-4,7-8H2,(H,25,26)
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More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473851
PNG
(2-hydroxy-4-(N- isobutylnaphthalene- 2-sulfonamido...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H21NO5S/c1-14(2)13-22(17-8-10-19(21(24)25)20(23)12-17)28(26,27)18-9-7-15-5-3-4-6-16(15)11-18/h3-12,14,23H,13H2,1-2H3,(H,24,25)
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More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473878
PNG
(US10858316, Compound jy-5-299)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H21NO5S/c1-14(2)13-22(17-8-10-20(23)19(12-17)21(24)25)28(26,27)18-9-7-15-5-3-4-6-16(15)11-18/h3-12,14,23H,13H2,1-2H3,(H,24,25)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473877
PNG
(2-hydroxy-5-(N- isobutylphenyl- sulfonamido) benzo...)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19NO5S/c1-12(2)11-18(24(22,23)14-6-4-3-5-7-14)13-8-9-16(19)15(10-13)17(20)21/h3-10,12,19H,11H2,1-2H3,(H,20,21)
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More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473877
PNG
(2-hydroxy-5-(N- isobutylphenyl- sulfonamido) benzo...)
Show SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19NO5S/c1-12(2)11-18(24(22,23)14-6-4-3-5-7-14)13-8-9-16(19)15(10-13)17(20)21/h3-10,12,19H,11H2,1-2H3,(H,20,21)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473857
PNG
(2-hydroxy-4-(N- isobutyl-4- methylphenyl- sulfonam...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C18H21NO5S/c1-12(2)11-19(14-6-9-16(18(21)22)17(20)10-14)25(23,24)15-7-4-13(3)5-8-15/h4-10,12,20H,11H2,1-3H3,(H,21,22)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473872
PNG
(3-(N- isobutyl- naphthalene-2- sulfonamido) benzoi...)
Show SMILES CC(C)CN(c1cccc(c1)C(O)=O)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H21NO4S/c1-15(2)14-22(19-9-5-8-18(12-19)21(23)24)27(25,26)20-11-10-16-6-3-4-7-17(16)13-20/h3-13,15H,14H2,1-2H3,(H,23,24)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473853
PNG
(4-(4-fluoro-N- isobutylphenyl- sulfonamido)- 2-hyd...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C17H18FNO5S/c1-11(2)10-19(13-5-8-15(17(21)22)16(20)9-13)25(23,24)14-6-3-12(18)4-7-14/h3-9,11,20H,10H2,1-2H3,(H,21,22)
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More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))
BDBM473850
PNG
(2-hydroxy-4-(N- isobutylphenyl- sulfonamido) benzo...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19NO5S/c1-12(2)11-18(24(22,23)14-6-4-3-5-7-14)13-8-9-15(17(20)21)16(19)10-13/h3-10,12,19H,11H2,1-2H3,(H,20,21)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473875
PNG
(3-(N-isobutyl-4- methylphenyl- sulfonamido) benzoi...)
Show SMILES CC(C)CN(c1cccc(c1)C(O)=O)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C18H21NO4S/c1-13(2)12-19(16-6-4-5-15(11-16)18(20)21)24(22,23)17-9-7-14(3)8-10-17/h4-11,13H,12H2,1-3H3,(H,20,21)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473850
PNG
(2-hydroxy-4-(N- isobutylphenyl- sulfonamido) benzo...)
Show SMILES CC(C)CN(c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19NO5S/c1-12(2)11-18(24(22,23)14-6-4-3-5-7-14)13-8-9-15(17(20)21)16(19)10-13/h3-10,12,19H,11H2,1-2H3,(H,20,21)
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Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473873
PNG
(3-(N-isobutyl-[1,1'- biphenyl]-4- ylsulfonamido) b...)
Show SMILES CC(C)CN(c1cccc(c1)C(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C23H23NO4S/c1-17(2)16-24(21-10-6-9-20(15-21)23(25)26)29(27,28)22-13-11-19(12-14-22)18-7-4-3-5-8-18/h3-15,17H,16H2,1-2H3,(H,25,26)
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More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473871
PNG
(3-(N- isobutylphenyl- sulfonamido) benzoic acid | ...)
Show SMILES CC(C)CN(c1cccc(c1)C(O)=O)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19NO4S/c1-13(2)12-18(15-8-6-7-14(11-15)17(19)20)23(21,22)16-9-4-3-5-10-16/h3-11,13H,12H2,1-2H3,(H,19,20)
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Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473848
PNG
(4-(4-fluoro-N- isobutylphenyl- sulfonamido) benzoi...)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)=O)S(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C17H18FNO4S/c1-12(2)11-19(15-7-3-13(4-8-15)17(20)21)24(22,23)16-9-5-14(18)6-10-16/h3-10,12H,11H2,1-2H3,(H,20,21)
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Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473846
PNG
(4-(N- isobutylnaphthalene- 2-sulfonamido) benzoic ...)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)=O)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H21NO4S/c1-15(2)14-22(19-10-7-17(8-11-19)21(23)24)27(25,26)20-12-9-16-5-3-4-6-18(16)13-20/h3-13,15H,14H2,1-2H3,(H,23,24)
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Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473845
PNG
(4-(N- isobutylphenyl- sulfonamido) benzoic acid | ...)
Show SMILES CC(C)CN(c1ccc(cc1)C(O)=O)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19NO4S/c1-13(2)12-18(15-10-8-14(9-11-15)17(19)20)23(21,22)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3,(H,19,20)
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Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM473874
PNG
(3-(4-fluoro-N- isobutylphenyl- sulfonamido) benzoi...)
Show SMILES CC(C)CN(c1cccc(c1)C(O)=O)S(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C17H18FNO4S/c1-12(2)11-19(15-5-3-4-13(10-15)17(20)21)24(22,23)16-8-6-14(18)7-9-16/h3-10,12H,11H2,1-2H3,(H,20,21)
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Ligand-Target Pair