CHEMBL2998 IC50
BioactivityChEMBL CHEMBL2998 IC50 bioactivity data
1127 compounds · Target: P2X purinoceptor 3 ( CHEMBL2998 ↗ ) · UniProt: P56373 ↗ · IC50
P2X purinoceptor 3, a molecular target studied in Homo sapiens.
| ID ↑ | SMILES | Target | Activity (nM) | Type | Ref | Link | |
|---|---|---|---|---|---|---|---|
|
66116 ↗ |
NS(=O)(=O)c1cc(NC(=O)Cc2ccccc2)ccc1Oc1cccc(Cl)c1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
8.30×103 | IC50 | CHEMBL4521594 | ChEMBL ↗ |
|
87782 ↗ |
CNC(=O)O[C@@H](CC(C)C)c1nc([C@H]2OC(=O)C/C=C/C(C)=C/[C@@H](O)[C@@H](C)/C=C(C)\C=C(C)/C=C/[C@@H](O)[C@H](C)[C@H](OC)/C(C)=C/C=C/[C@@H]2C)cs1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
438.00 | IC50 | CHEMBL1784269 | ChEMBL ↗ |
|
88044 ↗ |
CNC(=O)O[C@@H](CC(C)C)c1nc([C@H]2OC(=O)/C(C)=C/C/C(C)=C/[C@@H](O)[C@@H](C)/C=C(C)\C=C(C)/C=C/[C@@H](O)[C@H](C)[C@H](OC)/C(C)=C/C=C/[C@@H]2C)cs1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
86.10 | IC50 | CHEMBL241106 | ChEMBL ↗ |
|
88072 ↗ |
CO/C1=C\C(C)=C\[C@@H](C)[C@@H](O)[C@@H](C)C/C(C)=C/C=C/[C@H](OC)[C@@H]([C@@H](C)[C@@H](O)[C@H](C)[C@@]2(O)C[C@@H](O)[C@H](C)[C@@H](C(C)C)O2)OC1=O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
755.00 | IC50 | CHEMBL290814 | ChEMBL ↗ |
|
88365 ↗ |
CNC(=O)O[C@@H](CC(C)C)c1nc([C@H]2OC(=O)/C=C/C/C(C)=C/[C@@H](O)[C@@H](C)/C=C(C)\C=C(C)/C=C/[C@@H](O)[C@H](C)[C@H](OC)/C(C)=C/C=C/[C@@H]2C)cs1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
353.00 | IC50 | CHEMBL411767 | ChEMBL ↗ |
|
88415 ↗ |
CO[C@@H]1/C(C)=C/C=C/CCOC(=O)C/C=C/C(C)=C/[C@@H](O)[C@@H](C)/C=C(C)\C=C(C)/C=C/[C@@H](O)[C@@H]1C
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
1.31×103 | IC50 | CHEMBL4471610 | ChEMBL ↗ |
|
88453 ↗ |
CNC(=O)O[C@@H](CC(C)C)c1nc([C@H]2OC(=O)[C@@H](C)/C=C/C(C)=C/[C@@H](O)[C@@H](C)/C=C(C)\C=C(C)/C=C/[C@@H](O)[C@H](C)[C@H](OC)/C(C)=C/C=C/[C@@H]2C)cs1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
648.00 | IC50 | CHEMBL4593430 | ChEMBL ↗ |
|
117793 ↗ |
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
1.60×103 | IC50 | CHEMBL103 | ChEMBL ↗ |
|
117794 ↗ |
O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(Cl)ncnc32)[C@H](O)[C@@H]1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
741.31 | IC50 | CHEMBL1160555 | ChEMBL ↗ |
|
117795 ↗ |
CNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
1.29×103 | IC50 | CHEMBL1199042 | ChEMBL ↗ |
|
117796 ↗ |
CNc1ncnc2c1ncn2[C@H]1C[C@H](OP(=O)(O)O)[C@@H](COP(=O)(O)O)O1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
12.90×103 | IC50 | CHEMBL129841 | ChEMBL ↗ |
|
117797 ↗ |
CCOC(=O)c1ccc(N2C(=O)C(O)=C(C(C)=O)C2c2ccccc2)cc1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
4.79×103 | IC50 | CHEMBL1456917 | ChEMBL ↗ |
|
117798 ↗ |
CCN(CC)C(=O)N1c2ccccc2C=Cc2ccccc21
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
14.20×103 | IC50 | CHEMBL1483754 | ChEMBL ↗ |
|
117799 ↗ |
CC(=O)N1CCN(c2nc(NC(C)(C)Cc3ccc(Cl)cc3)c3c(n2)C(=O)N(C(C)C)C3)CC1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
22.50 | IC50 | CHEMBL2011112 | ChEMBL ↗ |
|
117800 ↗ |
CC(=O)N1CCN(c2nc(NCc3cnc4ccccc4c3)c3c(n2)C(=O)N(C(C)C)C3)CC1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
24.00 | IC50 | CHEMBL2011125 | ChEMBL ↗ |
|
117801 ↗ |
CC(=O)N1CCN(c2nc(N[C@H](C)c3cnc4ccccc4c3)c3c(n2)C(=O)N(C(C)C)C3)CC1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
21.00 | IC50 | CHEMBL2324342 | ChEMBL ↗ |
|
117802 ↗ |
O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc2ccccc2c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
195.00 | IC50 | CHEMBL2338686 | ChEMBL ↗ |
|
117803 ↗ |
Cc1nc(/N=N/c2ccc(C(=O)O)cc2)c(CCC(=O)O)c(C=O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
79.80 | IC50 | CHEMBL2376118 | ChEMBL ↗ |
|
117804 ↗ |
Cc1nc(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(CCC(=O)O)c(C=O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
106.00 | IC50 | CHEMBL2376126 | ChEMBL ↗ |
|
117805 ↗ |
Cc1nc(CCc2ccccc2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
797.00 | IC50 | CHEMBL3091605 | ChEMBL ↗ |
|
117806 ↗ |
Cc1nc(/C=C/c2ccccc2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
920.00 | IC50 | CHEMBL3091606 | ChEMBL ↗ |
|
117807 ↗ |
COc1ccc(CCc2nc(C)c(O)c(C(=O)O)c2C(=O)O)cc1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
460.00 | IC50 | CHEMBL3091607 | ChEMBL ↗ |
|
117808 ↗ |
Cc1nc(CCc2ccc(C(=O)O)cc2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
458.00 | IC50 | CHEMBL3091610 | ChEMBL ↗ |
|
117809 ↗ |
Cc1nc(Cc2cccc3ccccc23)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
1.25×103 | IC50 | CHEMBL3091617 | ChEMBL ↗ |
|
117810 ↗ |
Cc1nc(CC(c2ccccc2)c2ccccc2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
824.00 | IC50 | CHEMBL3091618 | ChEMBL ↗ |
|
117811 ↗ |
Cc1nc(Cc2cccc(Oc3ccccc3)c2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
474.00 | IC50 | CHEMBL3091619 | ChEMBL ↗ |
|
117812 ↗ |
Cc1nc(CCc2cccc(Oc3ccccc3)c2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
587.00 | IC50 | CHEMBL3091620 | ChEMBL ↗ |
|
117813 ↗ |
Cc1nc(-c2cccc(Oc3ccccc3)c2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
3.30×103 | IC50 | CHEMBL3091621 | ChEMBL ↗ |
|
117814 ↗ |
Cc1nc(Cc2ccc(Oc3ccccc3)cc2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
1.05×103 | IC50 | CHEMBL3091622 | ChEMBL ↗ |
|
117815 ↗ |
Cc1nc(Cc2ccccc2Oc2ccccc2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
2.93×103 | IC50 | CHEMBL3091623 | ChEMBL ↗ |
|
117816 ↗ |
Cc1nc(NC(=O)c2ccccc2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
723.00 | IC50 | CHEMBL3091625 | ChEMBL ↗ |
|
117817 ↗ |
Cc1nc(NC(=O)c2cccc(Oc3ccccc3)c2)c(C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
928.00 | IC50 | CHEMBL3091627 | ChEMBL ↗ |
|
117818 ↗ |
Cc1nc(Cc2cccc3ccccc23)c(/C=C/C(=O)O)c(C=O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
145.00 | IC50 | CHEMBL3091628 | ChEMBL ↗ |
|
117819 ↗ |
Cc1nc(Cc2cccc3ccccc23)c(CCC(=O)O)c(C=O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
636.00 | IC50 | CHEMBL3091629 | ChEMBL ↗ |
|
117820 ↗ |
Cc1nc(Cc2cccc(Oc3ccccc3)c2)c(/C=C/C(=O)O)c(C=O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
60.00 | IC50 | CHEMBL3091630 | ChEMBL ↗ |
|
117821 ↗ |
Cc1nc(Cc2cccc(Oc3ccccc3)c2)c(CCC(=O)O)c(C=O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
366.00 | IC50 | CHEMBL3091631 | ChEMBL ↗ |
|
117822 ↗ |
Cc1nc(Cc2cccc(Oc3ccccc3)c2)c(/C=C/C(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
377.00 | IC50 | CHEMBL3091632 | ChEMBL ↗ |
|
117823 ↗ |
Cc1nc(Cc2cccc(Oc3ccccc3)c2)c(CCC(=O)O)c(C(=O)O)c1O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
638.00 | IC50 | CHEMBL3091633 | ChEMBL ↗ |
|
117824 ↗ |
Cc1nc(Cc2cccc3ccccc23)c2c(c1O)C(O)OC2=O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
856.00 | IC50 | CHEMBL3091634 | ChEMBL ↗ |
|
117825 ↗ |
Cc1nc(Cc2cccc(Oc3ccccc3)c2)c2c(c1O)C(O)OC2=O
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
652.00 | IC50 | CHEMBL3091635 | ChEMBL ↗ |
|
117826 ↗ |
O=C(NC1CCCCC1)N1c2ccccc2C=Cc2ccccc21
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
28.00×103 | IC50 | CHEMBL3103369 | ChEMBL ↗ |
|
117827 ↗ |
O=C(N1CCCCC1)N1c2ccccc2C=Cc2ccccc21
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
7.98×103 | IC50 | CHEMBL3103371 | ChEMBL ↗ |
|
117828 ↗ |
O=C(N1CCCC1)N1c2ccccc2C=Cc2ccccc21
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
29.80×103 | IC50 | CHEMBL3103372 | ChEMBL ↗ |
|
117829 ↗ |
CCCN(CCC)C(=O)N1c2ccccc2C=Cc2ccccc21
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
15.20×103 | IC50 | CHEMBL3103375 | ChEMBL ↗ |
|
117830 ↗ |
CC(C)N(C(=O)N1c2ccccc2C=Cc2ccccc21)C(C)C
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
7.18×103 | IC50 | CHEMBL3103385 | ChEMBL ↗ |
|
117831 ↗ |
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]2OC3(O[C@H]21)C([N+](=O)[O-])=CC([N+](=O)[O-])C=C3[N+](=O)[O-]
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
18.00 | IC50 | CHEMBL337395 | ChEMBL ↗ |
|
117832 ↗ |
O=C1NC(=O)N(C2CCN(C(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)C1Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
600.00 | IC50 | CHEMBL3415342 | ChEMBL ↗ |
|
117833 ↗ |
COc1ccc(C(=O)C2C(=O)C(=O)N(c3ccc(-c4ccco4)cc3)C2C2CCCCC2)cc1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
12.00 | IC50 | CHEMBL3639685 | ChEMBL ↗ |
|
117834 ↗ |
COCCOc1ccccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccsc2)cc1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
7.00 | IC50 | CHEMBL3639686 | ChEMBL ↗ |
|
117835 ↗ |
COCCOc1ncccc1C1C(C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2cccs2)cc1
|
CHEMBL2998 ↗
UniProt: P56373 ↗ |
15.00 | IC50 | CHEMBL3639736 | ChEMBL ↗ |