P03372 | ESR1_HUMAN | Estrogen receptor (ESR1)

Pfam Domain Table

AccessionDomainRangeColor
PF00104Hormone_recep - Ligand-binding domain of nuclear hormone receptor337~530
PF00105zf-C4 - Double treble clef zinc finger, C4 type184~252
PF02159Oest_recep - Oestrogen receptor42~181
PF12743ESR1_C - Oestrogen-type nuclear receptor final C-terminal552~595

3D structures mapped by conservation among orthologs

[ Domain: "Nuclear receptor ligand-binding domain" // Hormone_recep_1 ]

 PyMOL session

[ Domain: "Nuclear receptor ligand-binding domain" // Hormone_recep ]

 PyMOL session

[ Domain: "LIM domain-like" // zf-C4 ]

 PyMOL session


[ Alpha Fold Model ] (go)



Known binders annotated in ChEMBL

 IC50 CSV    Ki CSV
Only the first 20 rows are shown.
molecule_chembl_idstructureassay_typerelation valueunitmol_wtsmilesorganism assay_chembl_idbao_label
CHEMBL42707 IC50 < 0.002 nM 473.59 O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccc(O)cc2)sc2cccc(O)c12 Homo sapiens CHEMBL4132005 cell-based format
CHEMBL4591338 IC50 = 0.01 nM 481.95 Oc1cccc(C2=C(Cl)c3cc(O)ccc3O[C@H]2c2ccc(OCCN3CC(CF)C3)cc2)c1 Homo sapiens CHEMBL4390558 cell-based format
CHEMBL4439408 IC50 = 0.024 nM 489.54 Oc1ccc2c(c1)OCCC1=C2C(c2ccc(OCCN3CC(CF)C3)cc2)Oc2ccc(O)cc21 Homo sapiens CHEMBL4424724 cell-based format
CHEMBL4441471 IC50 = 0.03 nM 497.97 CC1=C(c2ccc(F)cc2)[C@H](c2ccc(OCCN3CC(CF)C3)cc2)Oc2ccc(O)c(Cl)c21 Homo sapiens CHEMBL4390558 cell-based format
CHEMBL4464224 IC50 = 0.045 nM 489.54 Oc1ccc2c(c1)OC(c1ccc(OCCN3CC(CF)C3)cc1)C1=C2CCOc2cc(O)ccc21 Homo sapiens CHEMBL4424724 cell-based format
CHEMBL1193539 IC50 = 0.046 nM 492.04 O=C(c1ccc(OCCN2CCCCC2)cc1)c1c(-c2ccc(Cl)cc2)sc2cc(O)ccc12 Homo sapiens CHEMBL4132005 cell-based format
CHEMBL4455953 IC50 = 0.05 nM 461.53 CC1=C(c2cccc(O)c2)[C@H](c2ccc(OCCN3CC(CF)C3)cc2)Oc2c(O)cccc21 Homo sapiens CHEMBL4390558 cell-based format
CHEMBL4650316 IC50 = 0.05 nM 522.56 C[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(F)cc(NC3CN(CCCF)C3)cc2F)N1CC(F)(F)CO Homo sapiens CHEMBL4827352 cell-based format
CHEMBL4449709 IC50 = 0.051 nM 517.6 C[C@@H](COc1ccc(C2Oc3cc(O)ccc3C3=C2c2ccc(O)cc2OCC3)cc1)N1CC[C@@H](CF)C1 Homo sapiens CHEMBL4424724 cell-based format
CHEMBL4649161 IC50 = 0.053 nM 503.58 C[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(F)cc(OC3CN(CCCF)C3)cc2F)N1CC(C)(C)F Homo sapiens CHEMBL4619351 cell-based format
CHEMBL4437985 IC50 = 0.055 nM 489.54 Oc1ccc2c(c1)O[C@@H](c1ccc(OCCN3CC(CF)C3)cc1)C1=C2CCOc2cc(O)ccc21 Homo sapiens CHEMBL4424724 cell-based format
CHEMBL4464058 IC50 = 0.059 nM 489.54 Oc1ccc2c(c1)O[C@H](c1ccc(OCCN3CC(CF)C3)cc1)C1=C2CCOc2cc(O)ccc21 Homo sapiens CHEMBL4424724 cell-based format
CHEMBL149791 IC50 = 0.06 nM 316.4 CCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1 Homo sapiens CHEMBL4393300 single protein format
CHEMBL4866043 IC50 = 0.06 nM 540.55 C[C@@H]1Cc2c([nH]c3ccc(F)cc23)[C@@H](c2c(F)cc(NC3CN(CCCF)C3)cc2F)N1CC(F)(F)CO Homo sapiens CHEMBL4827352 cell-based format
CHEMBL4635493 IC50 = 0.065 nM 485.59 CCCN1CC(Oc2cc(F)c([C@@H]3c4[nH]c5ccccc5c4C[C@@H](C)N3CC(C)(C)F)c(F)c2)C1 Homo sapiens CHEMBL4619351 cell-based format
CHEMBL4463541 IC50 = 0.07 nM 451.58 CC1=C(C2CCCCC2)[C@H](c2ccc(OCCN3CC(CF)C3)cc2)Oc2ccc(O)cc21 Homo sapiens CHEMBL4390558 cell-based format
CHEMBL4856969 IC50 = 0.07 nM 520.57 C[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(F)cc(NC3CN(CCCO)C3)cc2F)N1CC(F)(F)CO Homo sapiens CHEMBL4827352 cell-based format
CHEMBL4539802 IC50 = 0.076 nM 503.57 Oc1ccc2c(c1)OC(c1ccc(OCCN3CC[C@@H](CF)C3)cc1)C1=C2CCOc2cc(O)ccc21 Homo sapiens CHEMBL4424724 cell-based format
CHEMBL4594150 IC50 = 0.08 nM 435.5 CC1=C(c2cn[nH]c2)[C@H](c2ccc(OCCN3CC(CF)C3)cc2)Oc2ccc(O)cc21 Homo sapiens CHEMBL4390558 cell-based format
CHEMBL4856892 IC50 = 0.08 nM 521.56 C[C@@H]1Cc2c([nH]c3ccccc23)[C@@H](c2c(F)cc(OC3CN(CCCO)C3)cc2F)N1CC(F)(F)CO Homo sapiens CHEMBL4827352 cell-based format