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Name | Relaxin receptor 1 |
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Species | Homo sapiens (Human) |
Gene | RXFP1 |
Synonym | Relaxin family peptide receptor 1 RX1 relaxin/insulin like family peptide receptor 1 relaxin receptor 1 RXFPR1 [ Show all ] |
Disease | Acute heart failure |
Length | 757 |
Amino acid sequence | MTSGSVFFYILIFGKYFSHGGGQDVKCSLGYFPCGNITKCLPQLLHCNGVDDCGNQADEDNCGDNNGWSLQFDKYFASYYKMTSQYPFEAETPECLVGSVPVQCLCQGLELDCDETNLRAVPSVSSNVTAMSLQWNLIRKLPPDCFKNYHDLQKLYLQNNKITSISIYAFRGLNSLTKLYLSHNRITFLKPGVFEDLHRLEWLIIEDNHLSRISPPTFYGLNSLILLVLMNNVLTRLPDKPLCQHMPRLHWLDLEGNHIHNLRNLTFISCSNLTVLVMRKNKINHLNENTFAPLQKLDELDLGSNKIENLPPLIFKDLKELSQLNLSYNPIQKIQANQFDYLVKLKSLSLEGIEISNIQQRMFRPLMNLSHIYFKKFQYCGYAPHVRSCKPNTDGISSLENLLASIIQRVFVWVVSAVTCFGNIFVICMRPYIRSENKLYAMSIISLCCADCLMGIYLFVIGGFDLKFRGEYNKHAQLWMESTHCQLVGSLAILSTEVSVLLLTFLTLEKYICIVYPFRCVRPGKCRTITVLILIWITGFIVAFIPLSNKEFFKNYYGTNGVCFPLHSEDTESIGAQIYSVAIFLGINLAAFIIIVFSYGSMFYSVHQSAITATEIRNQVKKEMILAKRFFFIVFTDALCWIPIFVVKFLSLLQVEIPGTITSWVVIFILPINSALNPILYTLTTRPFKEMIHRFWYNYRQRKSMDSKGQKTYAPSFIWVEMWPLQEMPPELMKPDLFTYPCEMSLISQSTRLNSYS |
UniProt | Q9HBX9 |
Protein Data Bank | 2jm4 |
GPCR-HGmod model | N/A |
3D structure model | This structure is from PDB ID 2jm4. |
BioLiP | BL0101296 |
Therapeutic Target Database | T73696 |
ChEMBL | CHEMBL1293316 |
IUPHAR | 351 |
DrugBank | N/A |
Name | MLS001018867 |
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Molecular formula | C21H18N4O4 |
IUPAC name | 4-[2-(6-amino-1-benzyl-3-methyl-2,4-dioxopyrimidin-5-yl)-2-oxoethoxy]benzonitrile |
Molecular weight | 390.399 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.3 |
Synonyms | BDBM90607 cid_2086676 4-[2-(6-amino-1-benzyl-2,4-diketo-3-methyl-pyrimidin-5-yl)-2-keto-ethoxy]benzonitrile 4-[2-[4-azanyl-1-methyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-5-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile SMR000385338 [ Show all ] |
Inchi Key | FVBDGWCLWDOGFC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H18N4O4/c1-24-20(27)18(17(26)13-29-16-9-7-14(11-22)8-10-16)19(23)25(21(24)28)12-15-5-3-2-4-6-15/h2-10H,12-13,23H2,1H3 |
PubChem CID | 2086676 |
ChEMBL | CHEMBL1537193 |
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 | 8703.5 nM | PubChem BioAssay data set | ChEMBL |
Potency | 17782.8 nM | PubChem BioAssay data set | ChEMBL |
Potency | 30881.0 nM | PubChem BioAssay data set | ChEMBL |
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