CHEMBL228 IC50
BioactivityChEMBL CHEMBL228 IC50 bioactivity data
1860 compounds · Target: Sodium-dependent serotonin transporter ( CHEMBL228 ↗ ) · UniProt: P31645 ↗ · IC50
Sodium-dependent serotonin transporter, a molecular target studied in Homo sapiens.
| ID ↑ | SMILES | Target | Activity (nM) | Type | Ref | Link | |
|---|---|---|---|---|---|---|---|
|
4690 ↗ |
CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
1.70 | IC50 | CHEMBL4128926 | ChEMBL ↗ |
|
6669 ↗ |
C[C@H]1CN(c2ccc(C(=O)Nc3ccccc3N)cn2)CCN1C(=O)OCc1ccccc1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
1.68×103 | IC50 | CHEMBL236902 | ChEMBL ↗ |
|
34000 ↗ |
Cc1cccc(N2CCN(CCc3ccc4[nH]nnc4c3)CC2)c1C
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
260.00 | IC50 | CHEMBL184770 | ChEMBL ↗ |
|
34080 ↗ |
COc1cccc2c1CCCC2CN(C)CCc1cccc(F)c1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
160.00 | IC50 | CHEMBL198045 | ChEMBL ↗ |
|
34081 ↗ |
CCN(CC)C(=O)[C@@]1(c2ccccc2)CC1CNCC(O)COc1cccc2[nH]ccc12
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
120.00 | IC50 | CHEMBL198072 | ChEMBL ↗ |
|
34167 ↗ |
CCN(CCCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
24.10 | IC50 | CHEMBL208605 | ChEMBL ↗ |
|
34169 ↗ |
NC(=O)c1ccc(F)c2c1C[C@@H](N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
18.70 | IC50 | CHEMBL208773 | ChEMBL ↗ |
|
34170 ↗ |
NC(=O)c1ccc(F)c2c1C[C@H](N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
17.40 | IC50 | CHEMBL208774 | ChEMBL ↗ |
|
34180 ↗ |
CCN(CCCc1c[nH]c2ccc(F)cc12)C1COc2cccc(OC)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
64.00 | IC50 | CHEMBL209262 | ChEMBL ↗ |
|
34183 ↗ |
CCCN(CCCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
217.00 | IC50 | CHEMBL209784 | ChEMBL ↗ |
|
34184 ↗ |
NC(=O)c1ccc(F)c2c1C[C@@H](N(CCCc1c[nH]c3ccc(F)cc13)CC1CC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
59.70 | IC50 | CHEMBL209802 | ChEMBL ↗ |
|
34191 ↗ |
CCN(CCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
883.00 | IC50 | CHEMBL210348 | ChEMBL ↗ |
|
34200 ↗ |
COc1cccc2c1CC(N(C)CCCc1c[nH]c3ccc(F)cc13)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
15.00 | IC50 | CHEMBL210656 | ChEMBL ↗ |
|
34204 ↗ |
NC(=O)c1ccc(F)c2c1C[C@H](N(CCCc1c[nH]c3ccc(F)cc13)CC1CC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
36.30 | IC50 | CHEMBL210978 | ChEMBL ↗ |
|
34207 ↗ |
CCN(CCCc1c[nH]c2ccc(F)cc12)[C@@H]1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
37.30 | IC50 | CHEMBL211215 | ChEMBL ↗ |
|
34221 ↗ |
COc1cccc2c1C[C@@H](N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
732.00 | IC50 | CHEMBL211363 | ChEMBL ↗ |
|
34222 ↗ |
CCN(CCCc1c[nH]c2ccc(F)cc12)[C@H]1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
42.70 | IC50 | CHEMBL211393 | ChEMBL ↗ |
|
34223 ↗ |
COc1cccc2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)CC1CC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
42.60 | IC50 | CHEMBL211480 | ChEMBL ↗ |
|
34227 ↗ |
CCCN(CCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
128.00 | IC50 | CHEMBL213652 | ChEMBL ↗ |
|
34228 ↗ |
NC(=O)c1ccc(F)c2c1CC(N(CCCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
300.00 | IC50 | CHEMBL213673 | ChEMBL ↗ |
|
34229 ↗ |
CCCN(CCCc1c[nH]c2ccc(F)cc12)[C@@H]1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
59.90 | IC50 | CHEMBL214009 | ChEMBL ↗ |
|
34326 ↗ |
c1ccc2c(N3CCN(CCc4ccc5[nH]cnc5c4)CC3)cccc2c1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
1.76×103 | IC50 | CHEMBL2298806 | ChEMBL ↗ |
|
34459 ↗ |
COc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2ccoc2c1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
13.00 | IC50 | CHEMBL268258 | ChEMBL ↗ |
|
34503 ↗ |
CC(N)Cc1c[nH]c2ccccc12
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
2.34×103 | IC50 | CHEMBL30713 | ChEMBL ↗ |
|
35033 ↗ |
CCCN(CCCc1c[nH]c2ccc(F)cc12)C1COc2cccc(OC)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
386.00 | IC50 | CHEMBL378073 | ChEMBL ↗ |
|
35038 ↗ |
NC(=O)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
25.20 | IC50 | CHEMBL380095 | ChEMBL ↗ |
|
35041 ↗ |
NC(=O)c1ccc(F)c2c1C[C@@H](NCCCc1c[nH]c3ccc(F)cc13)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
197.00 | IC50 | CHEMBL380401 | ChEMBL ↗ |
|
35073 ↗ |
NC(=O)c1ccc(F)c2c1CC(N(CCCCc1c[nH]c3ccc(F)cc13)CC1CC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
82.40 | IC50 | CHEMBL385353 | ChEMBL ↗ |
|
35074 ↗ |
CN(CCCc1c[nH]c2ccc(F)cc12)[C@H]1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
116.00 | IC50 | CHEMBL386242 | ChEMBL ↗ |
|
35075 ↗ |
COc1cccc2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
400.00 | IC50 | CHEMBL386288 | ChEMBL ↗ |
|
35366 ↗ |
COc1ccccc1N1CCN(CCCN2CCOc3ccccc32)CC1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
195.02 | IC50 | CHEMBL4204665 | ChEMBL ↗ |
|
35449 ↗ |
COCCOc1cc(CC2CCN(CCc3ccc4c(c3)C(=O)CCO4)CC2)ccc1Br
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
2.71 | IC50 | CHEMBL4226281 | ChEMBL ↗ |
|
35459 ↗ |
COCCOc1cc(CC2CCN(CCc3ccc4c(c3)C(=O)CCO4)CC2)ccc1Cl
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
16.40 | IC50 | CHEMBL4228158 | ChEMBL ↗ |
|
35463 ↗ |
COCCOc1cc(CC2CCN(CCc3ccc4c(c3)C(=O)CCO4)CC2)ccc1C
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
45.30 | IC50 | CHEMBL4228775 | ChEMBL ↗ |
|
35523 ↗ |
NC(=O)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)CC1CC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
53.50 | IC50 | CHEMBL427051 | ChEMBL ↗ |
|
35524 ↗ |
CCCN(CCCc1c[nH]c2ccc(F)cc12)[C@H]1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
181.00 | IC50 | CHEMBL427411 | ChEMBL ↗ |
|
35924 ↗ |
CCCN(CCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(C(=O)NC)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
24.30 | IC50 | CHEMBL457750 | ChEMBL ↗ |
|
35925 ↗ |
CCCN(CCCc1c[nH]c2ccc(F)cc12)[C@H]1COc2c(F)ccc(C(=O)NC)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
47.00 | IC50 | CHEMBL457751 | ChEMBL ↗ |
|
35932 ↗ |
CC(C)CCO[C@@H]1[C@H]2OC(C)(C)O[C@H]2[C@H]2Cn3cc(nn3)COCCCCCCN(CCc3ccc4ccccc4c3)CC[C@H]1O2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
7.40×103 | IC50 | CHEMBL4579120 | ChEMBL ↗ |
|
36222 ↗ |
NC(=O)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(Cl)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
612.00 | IC50 | CHEMBL483573 | ChEMBL ↗ |
|
36223 ↗ |
CCNC(=O)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
27.90 | IC50 | CHEMBL483594 | ChEMBL ↗ |
|
36226 ↗ |
CCCN(CCCc1c[nH]c2ccc(F)cc12)C1COc2c(F)ccc(OC)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
442.00 | IC50 | CHEMBL484210 | ChEMBL ↗ |
|
36229 ↗ |
CCCN(CCCCn1ccc2cccc(F)c21)C1COc2c(F)ccc(C(N)=O)c2C1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
435.00 | IC50 | CHEMBL484355 | ChEMBL ↗ |
|
36233 ↗ |
NC(=O)c1ccc(F)c2c1CC(N(CCCCn1ccc3cccc(F)c31)CC1CC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
138.00 | IC50 | CHEMBL484537 | ChEMBL ↗ |
|
36234 ↗ |
O=C(NCC1CC1)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
43.60 | IC50 | CHEMBL484541 | ChEMBL ↗ |
|
36235 ↗ |
NC(=O)c1ccc(Cl)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
58.95 | IC50 | CHEMBL484572 | ChEMBL ↗ |
|
36237 ↗ |
COc1ccc2[nH]cc(CCCN(C3CCC3)C3COc4c(F)ccc(C(N)=O)c4C3)c2c1
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
834.00 | IC50 | CHEMBL484581 | ChEMBL ↗ |
|
36245 ↗ |
CCCNC(=O)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
32.70 | IC50 | CHEMBL484947 | ChEMBL ↗ |
|
36246 ↗ |
CC(C)NC(=O)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
44.70 | IC50 | CHEMBL484948 | ChEMBL ↗ |
|
36257 ↗ |
O=C(NC1CC1)c1ccc(F)c2c1CC(N(CCCc1c[nH]c3ccc(F)cc13)C1CCC1)CO2
|
CHEMBL228 ↗
UniProt: P31645 ↗ |
69.60 | IC50 | CHEMBL485385 | ChEMBL ↗ |