You can:
| Name | 5-hydroxytryptamine receptor 2A |
|---|---|
| Species | Homo sapiens (Human) |
| Gene | HTR2A |
| Synonym | 5-HT-2 serotonin receptor 2A serotonin 5HT-2 receptor 5-HT-2A 5-HT2A receptor [ Show all ] |
| Disease | Depression Unspecified Diabetes Erythropoietic porphyria Fibromyalgia [ Show all ] |
| Length | 471 |
| Amino acid sequence | MDILCEENTSLSSTTNSLMQLNDDTRLYSNDFNSGEANTSDAFNWTVDSENRTNLSCEGCLSPSCLSLLHLQEKNWSALLTAVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIADMLLGFLVMPVSMLTILYGYRWPLPSKLCAVWIYLDVLFSTASIMHLCAISLDRYVAIQNPIHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSFVSFFIPLTIMVITYFLTIKSLQKEATLCVSDLGTRAKLASFSFLPQSSLSSEKLFQRSIHREPGSYTGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNEDVIGALLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENKKPLQLILVNTIPALAYKSSQLQMGQKKNSKQDAKTTDNDCSMVALGKQHSEEASKDNSDGVNEKVSCV |
| UniProt | P28223 |
| Protein Data Bank | 6a93, 6a94 |
| GPCR-HGmod model | P28223 |
| 3D structure model | This structure is from PDB ID 6a93. |
| BioLiP | BL0441025,BL0441028, BL0441031, BL0441030,BL0441033, BL0441029,BL0441032, BL0441026, BL0441024,BL0441027 |
| Therapeutic Target Database | T32060 |
| ChEMBL | CHEMBL224 |
| IUPHAR | 6 |
| DrugBank | BE0000451 |
| Name | 1-(3-Chlorophenyl)piperazine |
|---|---|
| Molecular formula | C10H13ClN2 |
| IUPAC name | 1-(3-chlorophenyl)piperazine |
| Molecular weight | 196.678 |
| Hydrogen bond acceptor | 2 |
| Hydrogen bond donor | 1 |
| XlogP | 1.7 |
| Synonyms | VHFVKMTVMIZMIK-UHFFFAOYSA-N CAS-6640-24-0 D0S5FQ EC 229-654-7 KSC497Q2J [ Show all ] |
| Inchi Key | VHFVKMTVMIZMIK-UHFFFAOYSA-N |
| Inchi ID | InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2 |
| PubChem CID | 1355 |
| ChEMBL | CHEMBL478 |
| IUPHAR | 142 |
| BindingDB | 50001915 |
| DrugBank | DB12110 |
Structure |  |
| Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
| Parameter | Value | Reference | Database source |
|---|---|---|---|
| EC50 | 7.2 nM | PMID23537943 | ChEMBL |
| EC50 | 63.1 nM | PMID18095642 | ChEMBL |
| EC50 | 75.0 nM | PMID16257207, PMID15081042 | BindingDB,ChEMBL |
| EC50 | 167.0 nM | PMID19716297 | BindingDB,ChEMBL |
| EC50 | 251.0 nM | PMID27864071 | BindingDB |
| EC50 | 251.19 nM | PMID27864071 | ChEMBL |
| EC50 | 290.0 nM | PMID20022752, PMID17315987 | BindingDB,ChEMBL |
| Efficacy | 41.0 % | PMID16257207 | ChEMBL |
| Emax | 12.0 % | PMID27864071 | ChEMBL |
| Emax | 58.0 % | PMID19716297 | ChEMBL |
| Intrinsic activity | 0.3 - | PMID20022752 | ChEMBL |
| Ki | 25.0 nM | PMID27864071 | BindingDB |
| Ki | 25.12 nM | PMID27864071 | ChEMBL |
| Ki | 31.6228 - 158.489 nM | PMID15322733, PMID8534270, PMID9933142 | IUPHAR |
| Ki | 48.0 nM | PMID20022752, PMID17315987 | BindingDB,ChEMBL |
| Ki | 50.11 nM | PMID7582481 | PDSP,BindingDB |
| Ki | 54.0 nM | PMID16257207, PMID15081042 | PDSP,BindingDB,ChEMBL |
| Ki | 54.95 nM | PMID15322733 | BindingDB |
| Ki | 54.9541 nM | PMID15322733 | PDSP |
| Ki | 74.0 nM | PMID10611640 | PDSP,BindingDB |
| Ki | 85.0 nM | PMID14709324 | PDSP,BindingDB |
| Ki | 112.2 nM | PMID9225287 | PDSP,BindingDB |
| Ki | 196.4 nM | http://pdsp.med.unc.edu/pdsp.php | PDSP |
| Ki | 212.0 nM | PMID10611640 | PDSP,BindingDB |
| Ki | 223.87 nM | PMID10498829 | BindingDB |
| Ki | 223.872 nM | PMID10498829 | PDSP |
| Ki | 241.13 nM | Hamik & Peroutka, PMID1989 | PDSP |
| Ki | 273.0 nM | PMID26748694 | BindingDB,ChEMBL |
| Ki | 398.1 nM | PMID7582481 | PDSP,BindingDB |
| Relative efficacy | 41.0 % | PMID15081042 | ChEMBL |
zhanglab
zhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417