You can:
Name | Parathyroid hormone/parathyroid hormone-related peptide receptor |
---|---|
Species | Homo sapiens (Human) |
Gene | PTH1R |
Synonym | PTH1 receptor PTHR PTH/PTHrP type I receptor PTH/PTHr receptor PPR [ Show all ] |
Disease | N/A |
Length | 593 |
Amino acid sequence | MGTARIAPGLALLLCCPVLSSAYALVDADDVMTKEEQIFLLHRAQAQCEKRLKEVLQRPASIMESDKGWTSASTSGKPRKDKASGKLYPESEEDKEAPTGSRYRGRPCLPEWDHILCWPLGAPGEVVAVPCPDYIYDFNHKGHAYRRCDRNGSWELVPGHNRTWANYSECVKFLTNETREREVFDRLGMIYTVGYSVSLASLTVAVLILAYFRRLHCTRNYIHMHLFLSFMLRAVSIFVKDAVLYSGATLDEAERLTEEELRAIAQAPPPPATAAAGYAGCRVAVTFFLYFLATNYYWILVEGLYLHSLIFMAFFSEKKYLWGFTVFGWGLPAVFVAVWVSVRATLANTGCWDLSSGNKKWIIQVPILASIVLNFILFINIVRVLATKLRETNAGRCDTRQQYRKLLKSTLVLMPLFGVHYIVFMATPYTEVSGTLWQVQMHYEMLFNSFQGFFVAIIYCFCNGEVQAEIKKSWSRWTLALDFKRKARSGSSSYSYGPMVSHTSVTNVGPRVGLGLPLSPRLLPTATTNGHPQLPGHAKPGTPALETLETTPPAMAAPKDDGFLNGSCSGLDEEASGPERPPALLQEEWETVM |
UniProt | Q03431 |
Protein Data Bank | 6fj3, 3h3g, 3c4m |
GPCR-HGmod model | N/A |
3D structure model | This structure is from PDB ID 6fj3. |
BioLiP | BL0161387, BL0433539,BL0433540, BL0161388, BL0143680,BL0143682, BL0143681,BL0143683 |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL1793 |
IUPHAR | N/A |
DrugBank | N/A |
Name | MLS002603684 |
---|---|
Molecular formula | C30H40N2O6 |
IUPAC name | N-[2-(tert-butylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-[[(2R,5S)-5-[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]oxolan-2-yl]methyl]benzamide |
Molecular weight | 524.658 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 3.6 |
Synonyms | CHEMBL1713485 SMR001522414 2-(4-Methoxyphenyl)-2-[benzoyl[[(2S,2'S)-octahydro-5'alpha-(hydroxymethyl)-2,2'-bifuran-5alpha-yl]methyl]amino]-N-tert-butylacetamide HMS3096F10 UPCMLD23AJKM008639:001 |
Inchi Key | AEHHIWZVERCFNZ-HKQFDGPLSA-N |
Inchi ID | InChI=1S/C30H40N2O6/c1-30(2,3)31-28(34)27(20-10-12-22(36-4)13-11-20)32(29(35)21-8-6-5-7-9-21)18-23-14-16-25(37-23)26-17-15-24(19-33)38-26/h5-13,23-27,33H,14-19H2,1-4H3,(H,31,34)/t23-,24-,25+,26+,27?/m1/s1 |
PubChem CID | 42627847 |
ChEMBL | CHEMBL1713485 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Potency | 44668.4 nM | PubChem BioAssay data set | ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218