molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4244141 |
|
Ki |
= |
6.0 |
nM |
416.55 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2cccc(C=O)c2)c1 |
Homo sapiens |
CHEMBL4229691 |
single protein format |
CHEMBL205904 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
F
F
HN
NH
2
|
Ki |
= |
10.0 |
nM |
557.47 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2Cc1cc(F)ccc1F |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL399284 |
OBDepict
H
3
C
S
S
S
O
O
H
3
C
HN
O
S
O
O
CH
3
NH
H
2
N
|
Ki |
= |
14.0 |
nM |
565.76 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2NC(=O)CCCS(C)(=O)=O)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL377090 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
Cl
Cl
HN
NH
2
|
Ki |
= |
20.0 |
nM |
590.38 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2Cc1c(Cl)cccc1Cl |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL401398 |
OBDepict
CH
3
S
S
S
O
O
H
3
C
NH
2
HN
NH
2
|
Ki |
= |
20.0 |
nM |
417.58 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2N)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL403782 |
OBDepict
H
3
C
S
S
S
O
O
HN
H
3
C
HN
O
O
OH
NH
H
2
N
|
Ki |
= |
22.0 |
nM |
574.75 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2NC(=O)NCCCCCC(=O)O)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL4239924 |
OBDepict
CH
3
S
S
S
N
NH
H
2
N
N
H
S
O
O
F
F
|
Ki |
= |
30.0 |
nM |
522.65 |
CSc1sc(C(=N)N)cc1-c1nc(-c2cccc(NS(=O)(=O)c3ccc(F)cc3F)c2)cs1 |
Homo sapiens |
CHEMBL4229691 |
single protein format |
CHEMBL438807 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
HN
NH
2
|
Ki |
= |
30.0 |
nM |
521.49 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2Cc1ccccc1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL413993 |
OBDepict
CH
3
S
S
S
O
O
CH
3
HN
NH
2
|
Ki |
= |
30.0 |
nM |
402.57 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2ccccc2C)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL377281 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
F
+
N
O
_
O
HN
NH
2
|
Ki |
= |
30.0 |
nM |
584.47 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2Cc1cc([N+](=O)[O-])ccc1F |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL382350 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
F
F
HN
NH
2
|
Ki |
= |
40.0 |
nM |
557.47 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2Cc1c(F)cccc1F |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL252998 |
OBDepict
CH
3
S
S
S
O
O
Cl
HN
NH
2
|
Ki |
= |
40.0 |
nM |
422.98 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2ccccc2Cl)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL252004 |
OBDepict
CH
3
S
S
S
O
O
N
CH
3
HN
NH
2
|
Ki |
= |
40.0 |
nM |
403.55 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2cccc(C)n2)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL252203 |
OBDepict
H
3
C
S
S
S
O
O
H
3
C
HN
O
O
OH
NH
H
2
N
|
Ki |
= |
42.0 |
nM |
545.71 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2NC(=O)CCCCC(=O)O)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL2220483 |
OBDepict
H
2
N
NH
S
O
O
S
|
IC50 |
= |
46.0 |
nM |
302.38 |
N=C(N)c1cc2ccc(OC(=O)c3cccs3)cc2s1 |
Homo sapiens |
CHEMBL4229686 |
assay format |
CHEMBL206020 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
H
3
C
CH
3
HN
NH
2
|
Ki |
= |
50.0 |
nM |
499.48 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2CC=C(C)C |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL253646 |
OBDepict
H
3
C
S
S
S
O
O
H
3
C
OH
NH
H
2
N
|
Ki |
= |
50.0 |
nM |
432.59 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2CO)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL319394 |
OBDepict
CH
3
N
N
N
S
S
S
H
3
C
HN
NH
2
|
Ki |
= |
60.0 |
nM |
439.64 |
CCCc1c(-c2csc(-c3cc(C(=N)N)sc3SC)n2)cnn1-c1ccccc1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL254283 |
OBDepict
H
3
C
S
S
S
O
O
H
3
C
HN
HN
O
N
N
N
N
H
NH
H
2
N
|
Ki |
= |
64.0 |
nM |
556.7 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2NC(=O)NCCc2nn[nH]n2)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL317917 |
OBDepict
CH
3
O
N
N
N
N
S
S
S
CH
3
NH
H
2
N
|
Ki |
= |
70.0 |
nM |
456.62 |
CCCOc1c(-c2csc(-c3cc(C(=N)N)sc3SC)n2)cnn1-c1ccccn1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL381771 |
OBDepict
H
2
C
N
N
Br
S
O
O
S
S
H
3
C
HN
NH
2
|
Ki |
= |
70.0 |
nM |
471.43 |
C=CCn1cnc2cc(S(=O)(=O)c3cc(C(=N)N)sc3SC)cc(Br)c21 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL321341 |
OBDepict
CH
3
O
N
N
N
S
S
S
H
3
C
HN
NH
2
|
Ki |
= |
90.0 |
nM |
441.61 |
CCOc1c(-c2csc(-c3cc(C(=N)N)sc3SC)n2)cnn1-c1ccccc1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL382443 |
OBDepict
CH
3
S
S
S
O
O
Cl
N
N
F
F
HN
NH
2
|
Ki |
= |
100.0 |
nM |
513.02 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Cl)c2c(c1)ncn2Cc1c(F)cccc1F |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL205385 |
OBDepict
H
3
C
S
S
S
O
O
Cl
N
N
F
F
NH
H
2
N
|
Ki |
= |
100.0 |
nM |
513.02 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Cl)c2ncn(Cc3c(F)cccc3F)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL252619 |
OBDepict
H
3
C
S
S
S
O
O
H
3
C
HN
O
S
O
O
CH
3
NH
H
2
N
|
Ki |
= |
120.0 |
nM |
537.71 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2NC(=O)CS(C)(=O)=O)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL252794 |
OBDepict
H
3
C
S
S
S
O
O
OH
NH
H
2
N
|
Ki |
= |
120.0 |
nM |
418.57 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2ccccc2CO)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL273264 |
OBDepict
NH
2
HN
NH
O
O
NH
H
2
N
|
IC50 |
= |
140.0 |
nM |
347.38 |
N=C(N)Nc1ccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)cc1 |
Homo sapiens |
CHEMBL655973 |
single protein format |
CHEMBL253430 |
OBDepict
CH
3
S
S
S
O
O
CH
2
HN
NH
2
|
Ki |
= |
140.0 |
nM |
414.58 |
C=Cc1ccccc1-c1cccc(S(=O)(=O)c2cc(C(=N)N)sc2SC)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL252793 |
OBDepict
CH
3
S
S
S
O
O
OH
HN
NH
2
|
Ki |
= |
150.0 |
nM |
404.54 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2cccc(O)c2)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL400375 |
OBDepict
H
3
C
S
S
S
O
O
H
3
C
O
OH
NH
H
2
N
|
Ki |
= |
150.0 |
nM |
446.58 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2c(C)cccc2C(=O)O)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL322834 |
OBDepict
H
3
C
S
S
S
N
NH
H
2
N
N
N
|
Ki |
= |
150.0 |
nM |
397.55 |
CSc1sc(C(=N)N)cc1-c1nc(-c2cnn(-c3ccccc3)c2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL426490 |
OBDepict
H
3
C
S
S
S
O
O
Br
N
N
Cl
Cl
NH
H
2
N
|
Ki |
= |
160.0 |
nM |
590.38 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(Cc3c(Cl)cccc3Cl)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL381097 |
OBDepict
H
3
C
S
S
S
O
O
Br
N
N
F
+
N
O
_
O
NH
H
2
N
|
Ki |
= |
170.0 |
nM |
584.47 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(Cc3cc([N+](=O)[O-])ccc3F)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL205804 |
OBDepict
H
3
C
S
S
S
O
O
Br
N
N
F
F
NH
H
2
N
|
Ki |
= |
170.0 |
nM |
557.47 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(Cc3c(F)cccc3F)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL205342 |
OBDepict
H
3
C
S
S
S
O
O
Br
N
N
NH
H
2
N
|
Ki |
= |
180.0 |
nM |
507.46 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(-c3ccccc3)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL400497 |
OBDepict
CH
3
S
S
S
O
O
HO
HN
NH
2
|
Ki |
= |
190.0 |
nM |
404.54 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2ccc(O)cc2)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL106388 |
OBDepict
CH
3
N
N
H
3
C
N
S
S
S
CH
3
NH
NH
2
|
Ki |
= |
190.0 |
nM |
377.56 |
CCCc1nn(C)cc1-c1csc(-c2cc(C(=N)N)sc2SC)n1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL380315 |
OBDepict
H
3
C
S
S
S
O
O
Br
N
N
CH
3
CH
3
NH
H
2
N
|
Ki |
= |
200.0 |
nM |
499.48 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(CC=C(C)C)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL377934 |
OBDepict
H
2
C
N
N
S
Br
O
O
S
S
CH
3
NH
H
2
N
|
Ki |
= |
210.0 |
nM |
471.43 |
C=CCn1cnc2c(Br)cc(S(=O)(=O)c3cc(C(=N)N)sc3SC)cc21 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL438267 |
OBDepict
H
3
C
S
S
S
O
O
Br
N
N
F
F
NH
H
2
N
|
Ki |
= |
240.0 |
nM |
557.47 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(Cc3cc(F)ccc3F)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL252591 |
OBDepict
CH
3
S
S
S
O
O
H
3
C
HN
NH
2
|
Ki |
= |
250.0 |
nM |
402.57 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2ccc(C)cc2)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL252393 |
OBDepict
CH
3
S
S
S
O
O
HN
NH
2
|
Ki |
= |
260.0 |
nM |
388.54 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2ccccc2)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL317917 |
OBDepict
CH
3
O
N
N
N
N
S
S
S
CH
3
NH
H
2
N
|
IC50 |
= |
300.0 |
nM |
456.62 |
CCCOc1c(-c2csc(-c3cc(C(=N)N)sc3SC)n2)cnn1-c1ccccn1 |
Homo sapiens |
CHEMBL885071 |
single protein format |
CHEMBL204679 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
HN
NH
2
|
Ki |
= |
310.0 |
nM |
507.46 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2-c1ccccc1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL205657 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
CH
3
HN
NH
2
|
Ki |
= |
330.0 |
nM |
445.39 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(C)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL205578 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
CH
3
H
HN
NH
2
|
Ki |
= |
330.0 |
nM |
535.51 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2[C@@H](C)c1ccccc1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL318576 |
OBDepict
CH
3
N
CH
3
N
N
S
S
S
H
3
C
HN
H
2
N
|
Ki |
= |
330.0 |
nM |
377.56 |
CCCc1c(-c2csc(-c3cc(C(=N)N)sc3SC)n2)cnn1C |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL415092 |
OBDepict
CH
3
O
S
O
O
S
S
CH
3
HN
NH
2
|
Ki |
= |
350.0 |
nM |
418.57 |
COc1ccc(-c2cccc(S(=O)(=O)c3cc(C(=N)N)sc3SC)c2)cc1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL398527 |
OBDepict
CH
3
S
S
S
O
O
Br
HN
NH
2
|
Ki |
= |
360.0 |
nM |
391.34 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(Br)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL205354 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
CH
3
H
HN
NH
2
|
Ki |
= |
380.0 |
nM |
535.51 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2[C@H](C)c1ccccc1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL380325 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
H
3
C
HN
NH
2
|
Ki |
= |
400.0 |
nM |
445.39 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2c(c1)ncn2C |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL205698 |
OBDepict
CH
3
S
S
S
O
O
Br
N
N
H
HN
NH
2
|
Ki |
= |
400.0 |
nM |
431.36 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2[nH]cnc2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL204889 |
OBDepict
CH
3
S
S
S
O
O
N
N
HN
NH
2
|
Ki |
= |
400.0 |
nM |
442.59 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1ccc2c(c1)ncn2Cc1ccccc1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL379523 |
OBDepict
H
3
C
S
S
S
O
O
Br
N
N
NH
H
2
N
|
Ki |
= |
400.0 |
nM |
521.49 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cc(Br)c2ncn(Cc3ccccc3)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL380318 |
OBDepict
CH
3
S
S
S
O
O
HN
NH
2
|
Ki |
= |
410.0 |
nM |
362.5 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1ccc2ccccc2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL29304 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
H
3
C
|
Ki |
= |
420.0 |
nM |
345.52 |
CSc1sc(C(=N)N)cc1-c1nc(-c2ccc(C)cc2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL204936 |
OBDepict
H
3
C
S
S
S
O
O
N
N
NH
H
2
N
|
Ki |
= |
420.0 |
nM |
442.59 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1ccc2ncn(Cc3ccccc3)c2c1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL286243 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
Cl
|
Ki |
= |
436.0 |
nM |
365.94 |
CSc1sc(C(=N)N)cc1-c1nc(-c2ccc(Cl)cc2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL28875 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
S
|
Ki |
= |
450.0 |
nM |
387.58 |
CSc1sc(C(=N)N)cc1-c1nc(-c2csc3ccccc23)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL252592 |
OBDepict
CH
3
S
S
S
O
O
OH
HN
NH
2
|
Ki |
= |
460.0 |
nM |
404.54 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1cccc(-c2ccccc2O)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL102417 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
N
N
H
3
C
|
Ki |
= |
460.0 |
nM |
335.48 |
CSc1sc(C(=N)N)cc1-c1nc(-c2cnn(C)c2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL29205 |
OBDepict
CH
3
O
N
S
S
S
CH
3
HN
H
2
N
|
Ki |
= |
470.0 |
nM |
361.52 |
COc1cccc(-c2csc(-c3cc(C(=N)N)sc3SC)n2)c1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL29290 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
|
Ki |
= |
490.0 |
nM |
381.55 |
CSc1sc(C(=N)N)cc1-c1nc(-c2ccc3ccccc3c2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL399262 |
OBDepict
CH
3
O
S
O
O
S
S
CH
3
HN
NH
2
|
Ki |
= |
490.0 |
nM |
418.57 |
COc1cccc(-c2cccc(S(=O)(=O)c3cc(C(=N)N)sc3SC)c2)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL287292 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
O
|
Ki |
= |
520.0 |
nM |
361.52 |
CSc1sc(C(=N)N)cc1-c1nc(COc2ccccc2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL102835 |
OBDepict
H
3
C
S
S
S
N
NH
NH
2
N
O
N
|
Ki |
= |
530.0 |
nM |
481.67 |
CSc1sc(C(=N)N)cc1-c1nc(-c2cnn(-c3ccccc3)c2OCC2CCC2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL281899 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
|
Ki |
= |
560.0 |
nM |
331.49 |
CSc1sc(C(=N)N)cc1-c1nc(-c2ccccc2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL382447 |
OBDepict
CH
3
S
S
S
O
O
N
N
N
HN
NH
2
|
Ki |
= |
580.0 |
nM |
443.58 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1ccc2c(c1)ncn2Cc1ccccn1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL401087 |
OBDepict
CH
3
S
S
S
O
O
O
CH
3
HN
NH
2
|
Ki |
= |
610.0 |
nM |
418.57 |
COc1ccccc1-c1cccc(S(=O)(=O)c2cc(C(=N)N)sc2SC)c1 |
Homo sapiens |
CHEMBL927223 |
single protein format |
CHEMBL286267 |
OBDepict
CH
3
O
O
CH
3
N
S
S
S
CH
3
HN
H
2
N
|
Ki |
= |
640.0 |
nM |
391.54 |
COc1ccc(-c2csc(-c3cc(C(=N)N)sc3SC)n2)c(OC)c1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL31549 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
S
|
Ki |
= |
700.0 |
nM |
337.52 |
CSc1sc(C(=N)N)cc1-c1nc(-c2cccs2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL205489 |
OBDepict
CH
3
S
S
S
O
O
HN
NH
2
|
Ki |
= |
750.0 |
nM |
312.44 |
CSc1sc(C(=N)N)cc1S(=O)(=O)c1ccccc1 |
Homo sapiens |
CHEMBL865639 |
single protein format |
CHEMBL28949 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
CH
3
|
Ki |
= |
850.0 |
nM |
345.52 |
CSc1sc(C(=N)N)cc1-c1nc(-c2ccccc2C)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL283080 |
OBDepict
CH
3
S
S
S
N
NH
H
2
N
O
H
3
C
|
Ki |
= |
850.0 |
nM |
361.52 |
COc1ccccc1-c1csc(-c2cc(C(=N)N)sc2SC)n1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL413764 |
OBDepict
H
3
C
S
S
S
N
NH
H
2
N
+
N
Cl
O
_
O
|
Ki |
= |
860.0 |
nM |
410.93 |
CSc1sc(C(=N)N)cc1-c1nc(-c2ccc(Cl)c([N+](=O)[O-])c2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL28723 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
N
Cl
|
Ki |
= |
870.0 |
nM |
366.92 |
CSc1sc(C(=N)N)cc1-c1nc(-c2cnccc2Cl)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL4247936 |
OBDepict
O
N
H
H
N
O
H
3
C
CH
3
Cl
Cl
N
H
O
S
HN
NH
2
|
IC50 |
= |
900.0 |
nM |
536.49 |
CC(C)[C@@H](NC(=O)Cc1c(Cl)cccc1Cl)C(=O)N1CC=CC1C(=O)NCc1ccc(C(=N)N)s1 |
Homo sapiens |
CHEMBL4229690 |
single protein format |
CHEMBL28618 |
OBDepict
CH
3
S
S
S
N
NH
H
2
N
O
H
3
C
|
Ki |
= |
900.0 |
nM |
361.52 |
COc1ccc(-c2csc(-c3cc(C(=N)N)sc3SC)n2)cc1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL286498 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
H
3
C
|
Ki |
= |
960.0 |
nM |
345.52 |
CSc1sc(C(=N)N)cc1-c1nc(-c2cccc(C)c2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |
CHEMBL29006 |
OBDepict
CH
3
S
S
S
N
HN
NH
2
+
N
O
_
O
|
Ki |
= |
1000.0 |
nM |
376.49 |
CSc1sc(C(=N)N)cc1-c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 |
Homo sapiens |
CHEMBL666759 |
single protein format |