CHEMBL335 IC50
BioactivityChEMBL CHEMBL335 IC50 bioactivity data
2091 compounds · Target: Tyrosine-protein phosphatase non-receptor type 1 ( CHEMBL335 ↗ ) · UniProt: P18031 ↗ · IC50
Tyrosine-protein phosphatase non-receptor type 1, a molecular target studied in Homo sapiens.
| ID ↑ | SMILES | Target | Activity (nM) | Type | Ref | Link | |
|---|---|---|---|---|---|---|---|
|
12079 ↗ |
CC1(C)C=Cc2c(ccc(C(=O)/C=C/c3ccc(O)cc3)c2O)O1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
74.10×103 | IC50 | CHEMBL362378 | ChEMBL ↗ |
|
12724 ↗ |
Oc1cc(O)cc(/C=C/c2ccc(O)cc2O)c1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
27.13×103 | IC50 | CHEMBL43065 | ChEMBL ↗ |
|
12952 ↗ |
CC(C)=CCc1c(-c2ccc(O)cc2O)oc2c3c(cc(O)c2c1=O)OC(C)(C)C=C3
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
16.21×103 | IC50 | CHEMBL464006 | ChEMBL ↗ |
|
16141 ↗ |
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O)cc(O)c21
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
130.10×103 | IC50 | CHEMBL9352 | ChEMBL ↗ |
|
19581 ↗ |
C[C@H]1[C@H](C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
4.39×103 | IC50 | CHEMBL169 | ChEMBL ↗ |
|
19829 ↗ |
COc1ccc(C2CC(=O)c3ccc(O)cc3O2)cc1CC=C(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
16.50×103 | IC50 | CHEMBL229789 | ChEMBL ↗ |
|
19936 ↗ |
CC(C)=CCc1c(O)cc2oc3cc(O)c(O)c(CC=C(C)C)c3c(=O)c2c1O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
2.80×103 | IC50 | CHEMBL260553 | ChEMBL ↗ |
|
20027 ↗ |
COc1c(O)cc2oc3cc(O)c(CC=C(C)C)c(O)c3c(=O)c2c1CC=C(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
5.50×103 | IC50 | CHEMBL323197 | ChEMBL ↗ |
|
20696 ↗ |
CC(C)=CCc1cc([C@@H]2CC(=O)c3ccc(O)cc3O2)ccc1O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
29.20×103 | IC50 | CHEMBL558103 | ChEMBL ↗ |
|
20760 ↗ |
CCCCCCCC/C=C\CCCCCCCC(=O)O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
6.20×103 | IC50 | CHEMBL8659 | ChEMBL ↗ |
|
20908 ↗ |
O=C(O)/C=C/c1ccc(O)c(O)c1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
3.06×103 | IC50 | CHEMBL145 | ChEMBL ↗ |
|
24073 ↗ |
CC(C)=CC[C@@H](O)C1=CC(=O)c2c(O)ccc(O)c2C1=O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
25.00×103 | IC50 | CHEMBL9470 | ChEMBL ↗ |
|
28915 ↗ |
Oc1c(O)c(Br)c(Cc2c(Br)c(O)c(O)c(Br)c2Br)c(Br)c1Br
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
680.00 | IC50 | CHEMBL374829 | ChEMBL ↗ |
|
47755 ↗ |
COc1c(CC=C(C)C)c(O)cc2c1C[C@H](c1ccc(O)c(CC=C(C)C)c1O)CO2
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
5.90×103 | IC50 | CHEMBL1929043 | ChEMBL ↗ |
|
47776 ↗ |
COc1cc2c(cc1OC)-c1cc3ccc(OC)c(OC)c3c[n+]1CC2
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
234.00×103 | IC50 | CHEMBL206106 | ChEMBL ↗ |
|
48421 ↗ |
COc1cc2occ(-c3ccc(O)cc3O)c(=O)c2c(O)c1CC=C(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
5.30×103 | IC50 | CHEMBL3809337 | ChEMBL ↗ |
|
48767 ↗ |
COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@@H]3c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
16.82×103 | IC50 | CHEMBL454592 | ChEMBL ↗ |
|
58917 ↗ |
CC(C)=CCc1c(-c2ccc(O)cc2O)oc2cc3c(c(O)c2c1=O)C=CC(C)(C)O3
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
20.00×103 | IC50 | CHEMBL221907 | ChEMBL ↗ |
|
63747 ↗ |
CCCCCCCCCCCCCCCCCCCC(=O)O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
1.60×103 | IC50 | CHEMBL1173381 | ChEMBL ↗ |
|
64725 ↗ |
CCCCCC/C=C\CCCCCCCC(=O)O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
6.40×103 | IC50 | CHEMBL453509 | ChEMBL ↗ |
|
64760 ↗ |
CCCCCCCCCCCCCCCCCC(=O)O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
2.30×103 | IC50 | CHEMBL46403 | ChEMBL ↗ |
|
64956 ↗ |
CCCCCCCCCCCCCCCC(=O)O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
8.80×103 | IC50 | CHEMBL82293 | ChEMBL ↗ |
|
68574 ↗ |
COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
67.00×103 | IC50 | CHEMBL295124 | ChEMBL ↗ |
|
73773 ↗ |
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
37.90×103 | IC50 | CHEMBL249447 | ChEMBL ↗ |
|
84159 ↗ |
O=c1cc(-c2ccc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c2)oc2cc(O)cc(O)c12
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
7.40×103 | IC50 | CHEMBL63354 | ChEMBL ↗ |
|
84161 ↗ |
O=c1cc(-c2ccc(O)c(-c3c(O)cc4oc(-c5ccc(O)cc5)cc(=O)c4c3O)c2)oc2cc(O)cc(O)c12
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
6.20×103 | IC50 | CHEMBL63677 | ChEMBL ↗ |
|
95376 ↗ |
C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
91.80×103 | IC50 | CHEMBL451532 | ChEMBL ↗ |
|
103231 ↗ |
CC(C)=CCc1c(O)cc(-c2cc3ccc(O)cc3o2)cc1O
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
10.20×103 | IC50 | CHEMBL2018876 | ChEMBL ↗ |
|
108074 ↗ |
O=C(O)CN1C(=O)/C(=C/c2cccc(Oc3ccccc3)c2)SC1=S
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
86.80×103 | IC50 | CHEMBL1172417 | ChEMBL ↗ |
|
108092 ↗ |
O=C(O)CN1C(=O)/C(=C/c2ccc(Oc3ccccc3)cc2)SC1=S
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
63.90×103 | IC50 | CHEMBL1645387 | ChEMBL ↗ |
|
108231 ↗ |
O=C(O)CN1C(=O)/C(=C/c2cccc(OCc3ccccc3)c2)SC1=S
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
43.10×103 | IC50 | CHEMBL184768 | ChEMBL ↗ |
|
108232 ↗ |
O=C(O)CN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
56.00×103 | IC50 | CHEMBL185623 | ChEMBL ↗ |
|
110902 ↗ |
C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
1.50×103 | IC50 | CHEMBL269277 | ChEMBL ↗ |
|
114876 ↗ |
CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
5.93×103 | IC50 | CHEMBL201515 | ChEMBL ↗ |
|
120585 ↗ |
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(c(O)c12)C(=O)c1c(O)c(Cl)c(O)c(Cl)c1C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
2.81×103 | IC50 | CHEMBL4453336 | ChEMBL ↗ |
|
120598 ↗ |
COc1cc(O)c(Cl)c(C)c1-c1cc(O)cc2cc3c(c(O)c12)C(=O)c1c(cc(O)c(Cl)c1O)C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
2.70×103 | IC50 | CHEMBL4458937 | ChEMBL ↗ |
|
120605 ↗ |
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(c(O)c12)C(=O)c1c(cc(O)c(Cl)c1O)C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
8.27×103 | IC50 | CHEMBL4461708 | ChEMBL ↗ |
|
120609 ↗ |
COc1cc(O)c(Cl)c(C)c1-c1cc(O)cc2cc3c(c(O)c12)C(=O)c1c(O)cc(O)cc1C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
3.38×103 | IC50 | CHEMBL4465327 | ChEMBL ↗ |
|
120617 ↗ |
COc1cc(O)cc(C)c1-c1cc(O)cc2cc3c(c(O)c12)C(=O)c1c(cc(O)c(Cl)c1O)C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
7.69×103 | IC50 | CHEMBL4471983 | ChEMBL ↗ |
|
120618 ↗ |
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Br)c2cc3c(c(O)c12)C(=O)c1c(O)cc(O)cc1C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
2.62×103 | IC50 | CHEMBL4473832 | ChEMBL ↗ |
|
120621 ↗ |
COc1cc(O)c(Cl)c(C)c1-c1cc(O)cc2cc3c(c(O)c12)C(=O)c1c(O)c(Cl)c(O)c(Cl)c1C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
2.11×103 | IC50 | CHEMBL4475087 | ChEMBL ↗ |
|
120628 ↗ |
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(c(O)c12)C(=O)c1c(O)cc(O)cc1C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
2.68×103 | IC50 | CHEMBL4514758 | ChEMBL ↗ |
|
120641 ↗ |
COc1c(Cl)c(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(c(O)c12)C(=O)c1c(O)c(Cl)c(O)c(Cl)c1C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
340.00 | IC50 | CHEMBL4528755 | ChEMBL ↗ |
|
120644 ↗ |
COc1cc(O)cc(C)c1-c1cc(O)cc2cc3c(c(O)c12)C(=O)c1c(O)cc(O)cc1C3(C)C
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
9.85×103 | IC50 | CHEMBL4532631 | ChEMBL ↗ |
|
125936 ↗ |
O=C(O)c1c(-c2ccc(O)cc2)ccc(CO)c1C#Cc1ccc(O)cc1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
13.20×103 | IC50 | CHEMBL3585679 | ChEMBL ↗ |
|
130318 ↗ |
COc1ccc2c(c1CC=C(C)C)O[C@H]1c3ccc(O)cc3OC[C@@]21OC
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
19.30×103 | IC50 | CHEMBL1076430 | ChEMBL ↗ |
|
130319 ↗ |
CC1(C)CC[C@]2(C)CC[C@]3(C(=O)O)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
6.80×103 | IC50 | CHEMBL1081157 | ChEMBL ↗ |
|
130320 ↗ |
COc1ccc(-c2cc(-c3ccc(-c4c(Cc5ccccc5)sc5ccccc45)cc3)ccc2O[C@H](Cc2ccccc2)C(=O)O)cc1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
52.48 | IC50 | CHEMBL1082297 | ChEMBL ↗ |
|
130321 ↗ |
O=C(O)[C@@H](Cc1ccccc1)Oc1ccc(-c2ccc(-c3c(Cc4ccccc4)sc4ccccc34)cc2)cc1-c1ccc(Cl)cc1
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
52.48 | IC50 | CHEMBL1082298 | ChEMBL ↗ |
|
130322 ↗ |
O=C(O)[C@H](CCc1ccccc1)Oc1c(Br)cc(-c2ccc(-c3c(Cc4ccccc4)sc4ccccc34)cc2)cc1Br
|
CHEMBL335 ↗
UniProt: P18031 ↗ |
288.40 | IC50 | CHEMBL1082299 | ChEMBL ↗ |