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Name | Thyrotropin receptor |
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Species | Homo sapiens (Human) |
Gene | TSHR |
Synonym | LGR3 Thyroid-stimulating hormone receptor Thyrotropin Receptor TSH receptor TSH-R |
Disease | Thyroid cancer diagnosis Diagnostic test to differentiate primary and secondary hypothyroidism Thyroid cancer |
Length | 764 |
Amino acid sequence | MRPADLLQLVLLLDLPRDLGGMGCSSPPCECHQEEDFRVTCKDIQRIPSLPPSTQTLKLIETHLRTIPSHAFSNLPNISRIYVSIDVTLQQLESHSFYNLSKVTHIEIRNTRNLTYIDPDALKELPLLKFLGIFNTGLKMFPDLTKVYSTDIFFILEITDNPYMTSIPVNAFQGLCNETLTLKLYNNGFTSVQGYAFNGTKLDAVYLNKNKYLTVIDKDAFGGVYSGPSLLDVSQTSVTALPSKGLEHLKELIARNTWTLKKLPLSLSFLHLTRADLSYPSHCCAFKNQKKIRGILESLMCNESSMQSLRQRKSVNALNSPLHQEYEENLGDSIVGYKEKSKFQDTHNNAHYYVFFEEQEDEIIGFGQELKNPQEETLQAFDSHYDYTICGDSEDMVCTPKSDEFNPCEDIMGYKFLRIVVWFVSLLALLGNVFVLLILLTSHYKLNVPRFLMCNLAFADFCMGMYLLLIASVDLYTHSEYYNHAIDWQTGPGCNTAGFFTVFASELSVYTLTVITLERWYAITFAMRLDRKIRLRHACAIMVGGWVCCFLLALLPLVGISSYAKVSICLPMDTETPLALAYIVFVLTLNIVAFVIVCCCYVKIYITVRNPQYNPGDKDTKIAKRMAVLIFTDFICMAPISFYALSAILNKPLITVSNSKILLVLFYPLNSCANPFLYAIFTKAFQRDVFILLSKFGICKRQAQAYRGQRVPPKNSTDIQVQKVTHDMRQGLHNMEDVYELIENSHLTPKKQGQISEEYMQTVL |
UniProt | P16473 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | T60606 |
ChEMBL | CHEMBL1963 |
IUPHAR | 255 |
DrugBank | N/A |
Name | SMR000033466 |
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Molecular formula | C21H23FN4O4 |
IUPAC name | 2-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]piperazin-1-yl]-N-(4-fluorophenyl)acetamide |
Molecular weight | 414.437 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 1.8 |
Synonyms | MCULE-4514279739 AKOS001444700 EU-0066374 ZINC20767109 2-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]piperazin-1-yl]-N-(4-fluorophenyl)acetamide [ Show all ] |
Inchi Key | AHRJZNZFSBOQKY-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H23FN4O4/c22-15-1-3-16(4-2-15)23-20(27)12-25-7-9-26(10-8-25)13-21(28)24-17-5-6-18-19(11-17)30-14-29-18/h1-6,11H,7-10,12-14H2,(H,23,27)(H,24,28) |
PubChem CID | 3236610 |
ChEMBL | CHEMBL1372166 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Potency | 31622.8 nM | PubChem BioAssay data set | ChEMBL |
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