molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3632844 |
|
Ki |
= |
0.26 |
nM |
352.42 |
Nc1ccc(C(=O)c2ccc(-c3ccc(S(N)(=O)=O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632826 |
OBDepict
O
O
CH
3
CH
3
CH
3
S
O
O
NH
2
|
Ki |
= |
0.34 |
nM |
333.41 |
CC(C)(C)OC(=O)c1ccc(-c2ccc(S(N)(=O)=O)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632830 |
OBDepict
_
O
+
N
O
S
O
O
NH
2
|
Ki |
= |
0.41 |
nM |
278.29 |
NS(=O)(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632836 |
OBDepict
H
3
C
O
O
OH
S
O
O
NH
2
|
Ki |
= |
0.42 |
nM |
397.45 |
COC(=O)c1ccc(C(O)c2ccc(-c3ccc(S(N)(=O)=O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL186963 |
OBDepict
F
F
F
F
N
H
O
S
O
O
NH
2
|
Ki |
= |
0.47 |
nM |
388.34 |
NS(=O)(=O)c1ccc2c(c1)CC(NC(=O)c1c(F)c(F)cc(F)c1F)C2 |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL3632825 |
OBDepict
CH
3
O
O
S
O
O
NH
2
|
Ki |
= |
0.67 |
nM |
291.33 |
COC(=O)c1ccc(-c2ccc(S(N)(=O)=O)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632845 |
OBDepict
NH
2
S
O
O
NH
2
|
Ki |
= |
0.67 |
nM |
338.43 |
Nc1ccc(Cc2ccc(-c3ccc(S(N)(=O)=O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632829 |
OBDepict
HO
HN
O
S
O
O
NH
2
|
Ki |
= |
0.69 |
nM |
320.37 |
NS(=O)(=O)c1ccc(-c2ccc(C(=O)NCCO)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632827 |
OBDepict
HO
O
S
O
O
NH
2
|
Ki |
= |
0.75 |
nM |
277.3 |
NS(=O)(=O)c1ccc(-c2ccc(C(=O)O)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632833 |
OBDepict
HO
S
O
O
NH
2
|
Ki |
= |
0.77 |
nM |
339.42 |
NS(=O)(=O)c1ccc(-c2ccc(C(O)c3ccccc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632840 |
OBDepict
HO
O
S
O
O
NH
2
|
Ki |
= |
0.83 |
nM |
367.43 |
NS(=O)(=O)c1ccc(-c2ccc(Cc3ccc(C(=O)O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632832 |
OBDepict
O
S
O
O
NH
2
|
Ki |
= |
0.84 |
nM |
337.4 |
NS(=O)(=O)c1ccc(-c2ccc(C(=O)c3ccccc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL71611 |
OBDepict
F
H
2
N
S
Cl
HN
O
O
N
S
N
S
O
O
NH
2
|
Ki |
= |
0.9 |
nM |
387.83 |
Nc1c(F)cc(S(=O)(=O)Nc2nnc(S(N)(=O)=O)s2)cc1Cl |
Homo sapiens |
CHEMBL1211833 |
single protein format |
CHEMBL1813208 |
OBDepict
HO
O
N
H
N
N
N
H
N
N
H
O
OH
S
O
O
NH
2
|
Ki |
= |
0.92 |
nM |
425.43 |
NS(=O)(=O)c1ccc(Nc2nc(NCCC(=O)O)nc(NCCC(=O)O)n2)cc1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL3632838 |
OBDepict
O
O
OH
S
O
O
NH
2
|
Ki |
= |
0.93 |
nM |
381.41 |
NS(=O)(=O)c1ccc(-c2ccc(C(=O)c3ccc(C(=O)O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL208532 |
OBDepict
CH
3
N
H
O
S
O
O
NH
2
|
Ki |
= |
2.2 |
nM |
366.53 |
CCCCCCCCCC(=O)NC1Cc2ccc(S(N)(=O)=O)cc2C1 |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL364127 |
OBDepict
Cl
HN
O
S
O
O
NH
2
|
Ki |
= |
2.7 |
nM |
350.83 |
NS(=O)(=O)c1ccc2c(c1)CC(NC(=O)c1ccc(Cl)cc1)C2 |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL4079453 |
OBDepict
HO
N
O
S
O
O
NH
2
|
Ki |
= |
2.9 |
nM |
408.48 |
NS(=O)(=O)c1ccc(C(=O)N2CCc3cc(O)ccc3C2c2ccccc2)cc1 |
Homo sapiens |
CHEMBL4015668 |
single protein format |
CHEMBL4070634 |
OBDepict
CH
3
O
N
O
S
O
O
NH
2
|
Ki |
= |
3.2 |
nM |
422.51 |
COc1ccc2c(c1)CCN(C(=O)c1ccc(S(N)(=O)=O)cc1)C2c1ccccc1 |
Homo sapiens |
CHEMBL4015668 |
single protein format |
CHEMBL4068642 |
OBDepict
O
N
H
S
HO
O
O
NH
2
HO
|
Ki |
= |
3.2 |
nM |
424.48 |
NS(=O)(=O)c1ccc(C(=O)N2CCc3cc(O)c(O)cc3[C@H]2c2ccccc2)cc1 |
Homo sapiens |
CHEMBL4015668 |
single protein format |
CHEMBL4100218 |
OBDepict
O
N
S
HO
O
O
NH
2
HO
|
Ki |
= |
3.3 |
nM |
424.48 |
NS(=O)(=O)c1ccc(C(=O)N2CCc3cc(O)c(O)cc3C2c2ccccc2)cc1 |
Homo sapiens |
CHEMBL4015668 |
single protein format |
CHEMBL4095957 |
OBDepict
O
N
H
S
HO
O
O
NH
2
HO
|
Ki |
= |
3.4 |
nM |
424.48 |
NS(=O)(=O)c1ccc(C(=O)N2CCc3cc(O)c(O)cc3[C@@H]2c2ccccc2)cc1 |
Homo sapiens |
CHEMBL4015668 |
single protein format |
CHEMBL3632841 |
OBDepict
O
+
N
O
_
O
S
O
O
NH
2
|
Ki |
= |
3.6 |
nM |
382.4 |
NS(=O)(=O)c1ccc(-c2ccc(C(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632843 |
OBDepict
_
O
+
N
O
S
O
O
NH
2
|
Ki |
= |
3.7 |
nM |
368.41 |
NS(=O)(=O)c1ccc(-c2ccc(Cc3ccc([N+](=O)[O-])cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL3632831 |
OBDepict
NH
2
S
O
O
NH
2
|
Ki |
= |
3.7 |
nM |
248.31 |
Nc1ccc(-c2ccc(S(N)(=O)=O)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL1738787 |
OBDepict
HO
N
H
N
N
N
H
N
Cl
S
O
O
NH
2
|
Ki |
= |
3.8 |
nM |
344.78 |
NS(=O)(=O)c1ccc(Nc2nc(Cl)nc(NCCO)n2)cc1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL88115 |
OBDepict
O
N
H
N
S
N
O
HO
S
O
O
NH
2
|
Ki |
= |
4.0 |
nM |
280.29 |
NS(=O)(=O)c1nnc(NC(=O)CCC(=O)O)s1 |
Homo sapiens |
CHEMBL3825326 |
single protein format |
CHEMBL3632839 |
OBDepict
HO
O
OH
S
O
O
NH
2
|
Ki |
= |
4.0 |
nM |
383.43 |
NS(=O)(=O)c1ccc(-c2ccc(C(O)c3ccc(C(=O)O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL78755 |
OBDepict
O
HN
N
H
S
O
O
H
3
C
S
O
O
H
2
N
|
Ki |
= |
4.1 |
nM |
369.42 |
Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL2048917 |
OBDepict
CH
3
O
O
H
3
C
N
H
O
S
O
O
NH
2
|
Ki |
= |
4.3 |
nM |
364.42 |
COc1ccc(CCNC(=O)c2ccc(S(N)(=O)=O)cc2)cc1OC |
Homo sapiens |
CHEMBL2050864 |
single protein format |
CHEMBL4069601 |
OBDepict
H
3
C
O
O
CH
3
N
O
S
O
O
NH
2
|
Ki |
= |
4.3 |
nM |
452.53 |
COc1cc2c(cc1OC)C(c1ccccc1)N(C(=O)c1ccc(S(N)(=O)=O)cc1)CC2 |
Homo sapiens |
CHEMBL4015668 |
single protein format |
CHEMBL3823618 |
OBDepict
O
N
H
O
HO
S
HN
O
O
N
S
N
S
O
O
NH
2
|
Ki |
= |
4.4 |
nM |
435.47 |
NS(=O)(=O)c1nnc(NS(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)s1 |
Homo sapiens |
CHEMBL3825326 |
single protein format |
CHEMBL3632837 |
OBDepict
CH
3
O
O
S
O
O
NH
2
|
Ki |
= |
4.6 |
nM |
381.45 |
COC(=O)c1ccc(Cc2ccc(-c3ccc(S(N)(=O)=O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL205743 |
OBDepict
CH
3
N
H
O
S
O
O
NH
2
|
Ki |
= |
5.0 |
nM |
282.37 |
CCCC(=O)NC1Cc2ccc(S(N)(=O)=O)cc2C1 |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL1209039 |
OBDepict
O
N
H
N
S
N
S
O
O
NH
2
|
Ki |
= |
5.1 |
nM |
356.47 |
NS(=O)(=O)c1nnc(NC(=O)CC23CC4CC(CC(C4)C2)C3)s1 |
Homo sapiens |
CHEMBL1211833 |
single protein format |
CHEMBL2048933 |
OBDepict
CH
3
O
N
S
O
O
NH
2
S
O
O
NH
2
|
Ki |
= |
5.2 |
nM |
397.48 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL2050864 |
single protein format |
CHEMBL1085034 |
OBDepict
CH
3
N
H
O
H
3
C
S
O
O
NH
2
|
Ki |
= |
5.5 |
nM |
298.41 |
CCCCC(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL1785909 |
single protein format |
CHEMBL500454 |
OBDepict
CH
3
O
NH
O
Cl
S
O
O
NH
2
|
Ki |
= |
5.6 |
nM |
380.85 |
COc1ccc(Cl)cc1C(=O)NC1Cc2ccc(S(N)(=O)=O)cc2C1 |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL457996 |
OBDepict
NH
2
S
O
O
NH
2
|
Ki |
= |
5.8 |
nM |
212.27 |
NC1Cc2ccc(S(N)(=O)=O)cc2C1 |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL3613777 |
OBDepict
O
N
S
HO
O
O
NH
2
HO
|
Ki |
= |
5.8 |
nM |
348.38 |
NS(=O)(=O)c1ccc(C(=O)N2CCc3cc(O)c(O)cc3C2)cc1 |
Homo sapiens |
CHEMBL3614556 |
single protein format |
CHEMBL2107036 |
OBDepict
O
N
H
O
HO
S
O
O
NH
2
|
Ki |
= |
6.1 |
nM |
272.28 |
NS(=O)(=O)c1ccc(NC(=O)CCC(=O)O)cc1 |
Homo sapiens |
CHEMBL3825326 |
single protein format |
CHEMBL3754185 |
OBDepict
CH
3
HN
S
N
H
O
O
O
O
H
3
C
|
Ki |
= |
6.1 |
nM |
266.36 |
CCCCCCNS(=O)(=O)NCCC(=O)OC |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL3752852 |
OBDepict
CH
3
O
O
N
H
S
NH
O
O
H
3
C
CH
3
|
Ki |
= |
6.3 |
nM |
238.31 |
COC(=O)CCNS(=O)(=O)NCC(C)C |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL1923680 |
OBDepict
CH
3
O
N
S
O
O
NH
2
+
N
O
_
O
|
Ki |
= |
6.3 |
nM |
363.4 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1cccc([N+](=O)[O-])c1 |
Homo sapiens |
CHEMBL1926274 |
single protein format |
CHEMBL3752328 |
OBDepict
H
3
C
O
O
HN
H
S
N
H
O
O
F
|
Ki |
= |
6.5 |
nM |
366.41 |
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)NCc1ccc(F)cc1 |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL364869 |
OBDepict
NH
2
S
O
O
|
Ki |
= |
6.5 |
nM |
197.26 |
NS(=O)(=O)c1ccc2c(c1)CCC2 |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL1738792 |
OBDepict
H
3
C
O
O
N
H
N
N
N
H
N
Cl
S
O
O
NH
2
|
Ki |
= |
6.5 |
nM |
372.79 |
COC(=O)CNc1nc(Cl)nc(Nc2ccc(S(N)(=O)=O)cc2)n1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL1084063 |
OBDepict
H
3
C
N
H
O
H
3
C
S
O
O
NH
2
|
Ki |
= |
6.5 |
nM |
284.38 |
CCCC(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL1785909 |
single protein format |
CHEMBL273977 |
OBDepict
_
O
S
N
H
O
O
+
Na
|
Ki |
= |
6.6 |
nM |
201.22 |
O=S(=O)([O-])NC1CCCCC1.[Na+] |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL3632835 |
OBDepict
H
3
C
O
O
O
S
O
O
NH
2
|
Ki |
= |
6.7 |
nM |
395.44 |
COC(=O)c1ccc(C(=O)c2ccc(-c3ccc(S(N)(=O)=O)cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL2048934 |
OBDepict
H
3
C
O
N
S
O
O
NH
2
S
O
O
NH
2
|
Ki |
= |
6.7 |
nM |
411.51 |
CCOc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL2050864 |
single protein format |
CHEMBL1923678 |
OBDepict
CH
3
O
N
S
O
O
NH
2
F
|
Ki |
= |
6.8 |
nM |
336.39 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1ccc(F)cc1 |
Homo sapiens |
CHEMBL1926274 |
single protein format |
CHEMBL1083381 |
OBDepict
CH
3
N
H
O
CH
3
CH
3
S
O
O
NH
2
|
Ki |
= |
6.9 |
nM |
298.41 |
CCC(C)C(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL1785909 |
single protein format |
CHEMBL4643924 |
OBDepict
O
N
N
S
O
O
NH
2
O
F
|
Ki |
= |
6.9 |
nM |
391.42 |
NS(=O)(=O)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3F)CC2)cc1 |
Homo sapiens |
CHEMBL4606705 |
single protein format |
CHEMBL1813207 |
OBDepict
H
3
C
O
O
N
H
N
N
N
H
N
N
H
O
O
H
3
C
S
O
O
NH
2
|
Ki |
= |
7.0 |
nM |
425.43 |
COC(=O)CNc1nc(NCC(=O)OC)nc(Nc2ccc(S(N)(=O)=O)cc2)n1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL2387069 |
OBDepict
H
3
C
O
NH
S
O
O
H
2
N
|
Ki |
= |
7.0 |
nM |
230.29 |
COc1ccc(CCNS(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL2388682 |
single protein format |
CHEMBL1923682 |
OBDepict
CH
3
O
N
S
O
O
NH
2
H
2
N
|
Ki |
= |
7.1 |
nM |
333.41 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1cccc(N)c1 |
Homo sapiens |
CHEMBL1926274 |
single protein format |
CHEMBL190447 |
OBDepict
CH
3
H
3
C
O
B
CH
3
CH
3
O
HN
S
O
O
H
2
N
|
Ki |
= |
7.1 |
nM |
298.17 |
CC1(C)OB(c2ccc(NS(N)(=O)=O)cc2)OC1(C)C |
Homo sapiens |
CHEMBL1118591 |
single protein format |
CHEMBL3613776 |
OBDepict
CH
3
O
O
CH
3
N
O
S
O
O
NH
2
|
Ki |
= |
7.2 |
nM |
376.43 |
COc1cc2c(cc1OC)CN(C(=O)c1ccc(S(N)(=O)=O)cc1)CC2 |
Homo sapiens |
CHEMBL3614556 |
single protein format |
CHEMBL1813206 |
OBDepict
HO
O
N
H
N
N
N
H
N
N
H
O
HO
S
O
O
NH
2
|
Ki |
= |
7.2 |
nM |
397.37 |
NS(=O)(=O)c1ccc(Nc2nc(NCC(=O)O)nc(NCC(=O)O)n2)cc1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL205867 |
OBDepict
O
HN
F
F
F
F
F
S
O
O
NH
2
|
Ki |
= |
7.3 |
nM |
406.33 |
NS(=O)(=O)c1ccc2c(c1)CCC2NC(=O)c1c(F)c(F)c(F)c(F)c1F |
Homo sapiens |
CHEMBL1009247 |
single protein format |
CHEMBL3752390 |
OBDepict
CH
3
O
O
N
H
S
NH
O
O
|
Ki |
= |
7.3 |
nM |
286.35 |
COC(=O)CCNS(=O)(=O)NCCc1ccccc1 |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL1085093 |
OBDepict
CH
3
H
3
C
CH
3
H
3
C
CH
3
N
H
O
S
O
O
NH
2
|
Ki |
= |
7.3 |
nM |
312.44 |
CC(C)C(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C(C)(C)C |
Homo sapiens |
CHEMBL1785909 |
single protein format |
CHEMBL1813210 |
OBDepict
HO
N
H
O
OH
N
N
N
H
N
Cl
S
O
O
NH
2
|
Ki |
= |
7.4 |
nM |
388.79 |
NS(=O)(=O)c1ccc(Nc2nc(Cl)nc(NC(CO)C(=O)O)n2)cc1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL3752046 |
OBDepict
CH
3
O
O
HN
H
CH
3
H
3
C
S
N
H
O
O
F
|
Ki |
= |
7.4 |
nM |
318.37 |
COC(=O)[C@@H](NS(=O)(=O)NCc1ccc(F)cc1)C(C)C |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL1209038 |
OBDepict
O
N
H
N
S
N
S
O
O
NH
2
|
Ki |
= |
7.5 |
nM |
342.45 |
NS(=O)(=O)c1nnc(NC(=O)C23CC4CC(CC(C4)C2)C3)s1 |
Homo sapiens |
CHEMBL1211833 |
single protein format |
CHEMBL3754060 |
OBDepict
CH
3
O
O
N
H
S
NH
O
O
H
3
C
|
Ki |
= |
7.5 |
nM |
286.35 |
COC(=O)CCNS(=O)(=O)NC(C)c1ccccc1 |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL3098848 |
OBDepict
O
HN
S
O
O
NH
2
|
Ki |
= |
7.6 |
nM |
294.38 |
NS(=O)(=O)Cc1ccc(NC(=O)C2CC=CCC2)cc1 |
Homo sapiens |
CHEMBL3102436 |
single protein format |
CHEMBL1813219 |
OBDepict
HO
N
H
O
OH
N
N
N
H
N
N
H
O
OH
OH
S
O
O
NH
2
|
Ki |
= |
7.6 |
nM |
485.48 |
NS(=O)(=O)c1ccc(CCNc2nc(NC(CO)C(=O)O)nc(NC(CO)C(=O)O)n2)cc1 |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL1923679 |
OBDepict
CH
3
O
N
S
O
O
NH
2
H
3
C
|
Ki |
= |
7.7 |
nM |
332.43 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1ccc(C)cc1 |
Homo sapiens |
CHEMBL1926274 |
single protein format |
CHEMBL1822699 |
OBDepict
CH
3
N
CH
3
O
N
O
N
H
3
C
H
3
C
S
O
O
NH
2
|
Ki |
= |
7.7 |
nM |
596.75 |
CCN(CC)c1ccc2c(c1)Oc1cc(N(CC)CC)ccc1C21c2ccccc2C(=O)N1c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL1826757 |
single protein format |
CHEMBL3752037 |
OBDepict
CH
3
O
O
HN
H
S
N
H
O
O
H
3
C
H
3
C
|
Ki |
= |
7.7 |
nM |
314.41 |
COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)NCC(C)C |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL4554983 |
OBDepict
Br
HO
N
O
S
O
O
NH
2
|
Ki |
= |
7.7 |
nM |
439.33 |
NS(=O)(=O)c1ccc(C(=O)N2CCC(O)(c3ccc(Br)cc3)CC2)cc1 |
Homo sapiens |
CHEMBL4331765 |
single protein format |
CHEMBL4442611 |
OBDepict
Cl
HO
N
O
S
O
O
NH
2
|
Ki |
= |
7.8 |
nM |
394.88 |
NS(=O)(=O)c1ccc(C(=O)N2CCC(O)(c3ccc(Cl)cc3)CC2)cc1 |
Homo sapiens |
CHEMBL4331765 |
single protein format |
CHEMBL3754636 |
OBDepict
CH
3
O
O
HN
H
CH
3
H
3
C
S
N
H
O
O
H
3
C
H
3
C
|
Ki |
= |
7.8 |
nM |
266.36 |
COC(=O)[C@@H](NS(=O)(=O)NCC(C)C)C(C)C |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL1956769 |
OBDepict
HO
H
O
H
O
H
N
H
H
OH
H
OH
H
O
N
H
S
H
OH
H
H
HO
HO
H
HO
S
O
O
NH
2
|
Ki |
= |
7.8 |
nM |
583.64 |
NS(=O)(=O)c1ccc(CCNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL3613781 |
OBDepict
CH
3
O
N
O
S
O
O
NH
2
|
Ki |
= |
7.9 |
nM |
346.41 |
COc1ccc2c(c1)CCCN2C(=O)c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL3614556 |
single protein format |
CHEMBL1923674 |
OBDepict
CH
3
O
N
S
O
O
NH
2
|
Ki |
= |
7.9 |
nM |
318.4 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1ccccc1 |
Homo sapiens |
CHEMBL1926274 |
single protein format |
CHEMBL1956761 |
OBDepict
HO
H
O
H
HO
H
N
H
H
OH
H
OH
N
H
S
S
O
O
NH
2
|
Ki |
= |
8.0 |
nM |
421.5 |
NS(=O)(=O)c1ccc(CCNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL3754723 |
OBDepict
H
3
C
O
O
N
H
S
N
H
O
O
|
Ki |
= |
8.0 |
nM |
316.42 |
COC(=O)CCNS(=O)(=O)NC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3755046 |
single protein format |
CHEMBL1956762 |
OBDepict
HO
H
O
H
HO
H
N
H
H
OH
H
OH
N
H
S
N
H
O
S
O
O
NH
2
|
Ki |
= |
8.0 |
nM |
436.47 |
NS(=O)(=O)c1ccc(C(=O)NNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL1956766 |
OBDepict
HO
H
O
H
HO
H
N
H
H
OH
H
OH
N
H
S
N
H
O
S
O
O
NH
2
|
Ki |
= |
8.2 |
nM |
436.47 |
NS(=O)(=O)c1ccc(C(=O)NNC(=S)N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL1956743 |
OBDepict
CH
3
O
O
H
O
H
O
H
N
H
H
O
H
O
O
CH
3
N
H
S
O
H
3
C
O
H
3
C
S
O
O
NH
2
|
Ki |
= |
8.3 |
nM |
561.59 |
CC(=O)OC[C@H]1O[C@@H](NC(=S)Nc2ccc(S(N)(=O)=O)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL1923675 |
OBDepict
CH
3
O
N
S
O
O
NH
2
Br
|
Ki |
= |
8.3 |
nM |
397.29 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1ccc(Br)cc1 |
Homo sapiens |
CHEMBL1926274 |
single protein format |
CHEMBL1956773 |
OBDepict
HO
H
O
H
O
H
N
H
H
OH
H
OH
H
O
N
H
S
H
OH
H
H
HO
HO
H
HO
S
O
O
NH
2
|
Ki |
= |
8.4 |
nM |
583.64 |
NS(=O)(=O)c1ccc(CCNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL1822700 |
OBDepict
CH
3
N
CH
3
O
N
O
N
H
3
C
H
3
C
S
O
O
NH
2
|
Ki |
= |
8.4 |
nM |
596.75 |
CCN(CC)c1ccc2c(c1)Oc1cc(N(CC)CC)ccc1C21c2ccccc2C(=O)N1c1cccc(S(N)(=O)=O)c1 |
Homo sapiens |
CHEMBL1826757 |
single protein format |
CHEMBL1956744 |
OBDepict
H
3
C
O
O
H
O
H
O
H
N
H
H
O
H
O
O
H
3
C
NH
S
O
H
3
C
O
H
3
C
S
O
O
NH
2
|
Ki |
= |
8.5 |
nM |
575.62 |
CC(=O)OC[C@H]1O[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL1956774 |
OBDepict
HO
H
O
H
O
H
N
H
H
OH
H
OH
H
O
N
H
S
H
OH
N
H
H
H
HO
HO
H
HO
O
S
O
O
NH
2
|
Ki |
= |
8.5 |
nM |
598.61 |
NS(=O)(=O)c1ccc(C(=O)NNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL1956768 |
OBDepict
OH
H
O
H
O
H
N
H
H
HO
H
OH
H
O
HN
S
H
HO
H
H
HO
HO
H
HO
S
O
O
NH
2
|
Ki |
= |
8.5 |
nM |
569.61 |
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL3632842 |
OBDepict
HO
+
N
O
_
O
S
O
O
NH
2
|
Ki |
= |
8.5 |
nM |
384.41 |
NS(=O)(=O)c1ccc(-c2ccc(C(O)c3ccc([N+](=O)[O-])cc3)cc2)cc1 |
Homo sapiens |
CHEMBL3635736 |
single protein format |
CHEMBL2048929 |
OBDepict
H
3
C
O
N
H
S
O
O
NH
2
|
Ki |
= |
8.6 |
nM |
318.4 |
COc1ccc2c(c1)CCNC2c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL2050864 |
single protein format |
CHEMBL1923683 |
OBDepict
CH
3
O
N
S
O
O
NH
2
H
2
N
|
Ki |
= |
8.6 |
nM |
333.41 |
COc1ccc2c(c1)CCN(S(N)(=O)=O)C2c1ccc(N)cc1 |
Homo sapiens |
CHEMBL1926274 |
single protein format |
CHEMBL1956770 |
OBDepict
HO
H
O
H
O
H
N
H
H
OH
H
OH
H
O
N
H
S
H
OH
N
H
H
H
HO
HO
H
HO
O
S
O
O
NH
2
|
Ki |
= |
8.6 |
nM |
598.61 |
NS(=O)(=O)c1ccc(C(=O)NNC(=S)N[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1 |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL2048922 |
OBDepict
CH
3
O
N
H
O
S
O
O
NH
2
|
Ki |
= |
8.6 |
nM |
348.42 |
CCOc1cccc(CCNC(=O)c2ccc(S(N)(=O)=O)cc2)c1 |
Homo sapiens |
CHEMBL2050864 |
single protein format |
CHEMBL2048927 |
OBDepict
H
3
C
O
N
S
O
O
H
2
N
|
Ki |
= |
8.7 |
nM |
344.44 |
CCCOc1ccc2c(c1)CCN=C2c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL2050864 |
single protein format |
CHEMBL1956749 |
OBDepict
CH
3
O
O
H
O
H
O
H
N
H
H
O
H
O
O
CH
3
N
H
S
O
H
3
C
O
H
3
C
S
O
O
NH
2
|
Ki |
= |
8.7 |
nM |
589.65 |
CC(=O)OC[C@H]1O[C@@H](NC(=S)NCCc2ccc(S(N)(=O)=O)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL2048930 |
OBDepict
H
3
C
O
N
H
S
O
O
NH
2
|
Ki |
= |
8.7 |
nM |
332.43 |
CCOc1ccc2c(c1)CCNC2c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL2050864 |
single protein format |
CHEMBL1956745 |
OBDepict
CH
3
O
O
H
O
H
O
H
N
H
H
O
H
O
O
CH
3
N
H
S
O
H
3
C
O
H
3
C
S
O
O
NH
2
|
Ki |
= |
8.8 |
nM |
589.65 |
CC(=O)OC[C@H]1O[C@@H](NC(=S)NCCc2ccc(S(N)(=O)=O)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
Homo sapiens |
CHEMBL1959874 |
single protein format |
CHEMBL1813218 |
OBDepict
OH
O
N
H
H
3
C
N
N
N
H
N
N
H
CH
3
O
OH
S
O
O
NH
2
|
Ki |
= |
8.8 |
nM |
453.48 |
CC(Nc1nc(NCCc2ccc(S(N)(=O)=O)cc2)nc(NC(C)C(=O)O)n1)C(=O)O |
Homo sapiens |
CHEMBL1815535 |
single protein format |
CHEMBL2048925 |
OBDepict
H
3
C
O
N
S
O
O
H
2
N
|
Ki |
= |
8.9 |
nM |
316.38 |
COc1ccc2c(c1)CCN=C2c1ccc(S(N)(=O)=O)cc1 |
Homo sapiens |
CHEMBL2050864 |
single protein format |