Zhang Lab

National University of Singapore

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●D-I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●D-QUARK ●DRfold ●DRfold2 ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●ATGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●DMFold ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred ●TCRfinder

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●TM-search ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●DeepMSA2 ●rMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●HPmod ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

GLASS

You can:

Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
Go back to previous page.

GPCR

Name	Thyrotropin-releasing hormone receptor
Species	Rattus norvegicus (Rat)
Gene	Trhr
Synonym	Thyroliberin receptor TRH receptor TRH-R TRH-R1 TRH1 receptor
Disease	N/A for non-human GPCRs
Length	412
Amino acid sequence	MENETVSELNQTELPPQVAVALEYQVVTILLVVVICGLGIVGNIMVVLVVMRTKHMRTATNCYLVSLAVADLMVLVAAGLPNITDSIYGSWVYGYVGCLCITYLQYLGINASSCSITAFTIERYIAICHPIKAQFLCTFSRAKKIIIFVWAFTSIYCMLWFFLLDLNISTYKDAIVISCGYKISRNYYSPIYLMDFGVFYVMPMILATVLYGFIARILFLNPIPSDPKENSKTWKNDSTHQNKNMNLNTTNRCFNSTVSSRKQVTKMLAVVVILFALLWMPYRTLVVVNSFLSSPFQENWFLLFCRICIYLNSAINPVIYNLMSQKFRAAFRKLCNCKQKPTEKAANYSVALNYSVIKESDRFSTELDDITVTDTYVSTTKVSFDDTCLASEKNGPSSCTYGYSLTAKQEKI
UniProt	Q01717
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4553
IUPHAR	363
DrugBank	N/A

Ligand

Name	diazepam
Molecular formula	C16H13ClN2O
IUPAC name	7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one
Molecular weight	284.743
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	3.0
Synonyms	ZB000640 Saromet Serenzin SMR000058398 STK735517 Trankinon UNII-Q3JTX2Q7TU Valium (TN) Velium Ducene Diapax Aliseum Nivalen Eridan Diazapam Ansiolisina NSC-169897 Frustan Diazepam 1.0 mg/ml in Methanol Arzepam Paralium HMS3393N04 Diazepam Rectubes BCP9000199 Placidox 5 InChI=1/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H Diazepam-Eurogenerics BIDD:PXR0158 Q-pam Kratium 2 Calmocitene Relanium Liberetas CCRIS 6009 7-Chloro-1,3-dihydro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one Medipam Diazepin Condition 7-chloro-1-methyl-5-phenyl-1H-1,4-benzodiazepine-2(3H)on MLS000759402 Dizac DEA No. 2765 A3662/0155188 NCGC00178168-04 Zipan Sedipam Sibazon Spectrum3_001780 Tensopam Tranquirit Valaxona Valuzepam W-5055 Nerozen Duxen Diastat AN-23449 Notense Evacalm Diazemulus Anxionil NSC77518 Gihitan Diazepam Elmu Atilen Paxate HSDB 3057 Diazepam Stada Benzopin Pms-Diazepam KBio1_000967 Diazepamu BRN 0754371 Quetinil 1-Methyl-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one LA-111 Calmpose Ro 5-2805 LS-122 Ceregulart 7-Chloro-1-methyl-5-3H-1,4-benzodiazepin-2(1H)-one Methyl diazepinone Dipam D-Pam 7-Chloro-1-methyl-5-phenyl-2-oxo-2,3-dihydro-1H-benzo[f]-1,4-diazepine Morosan Drenian Diacepan AB02310 Wy 3467 S.A.R.L. Serenack Simasedan Stesolid Tox21_202458 Trazepam Valitran Vazen AKOS003367969 Neurolytril EINECS 207-122-5 Diastat, Valium Ansilive Novodipam Faustan, Diazepam (JP17/USP/INN) Apozepam Paceum Gubex Diazepam Intensol BCP0726000176 Placidox 10 Iazepam Diazepam, European Pharmacopoeia (EP) Reference Standard Bialzepam Prozepam Kiatrium C06948 Radizepam 2H-1, 7-chloro-1,3-dihydro-1-methyl-5-phenyl- Lembrol CC-26451 Ruhsitus 7-chloranyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one Mandrozep Diazepan CHEMBL12 7-chloro-1-methyl-5-phenyl-1,3-dihydro-[1,4]benzodiazepin-2-one Methyldiazepinone, pharmaceutical Disopam D0Y1YC 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one NCGC00178168-02 DSSTox_RID_75566 Dialar Zepaxid SCHEMBL21442 Servizepam Solis T-quil Tranqdyn Unisedil Valium R Vival Duksen Diapine Alupram Nixtensyn Euphorin P Diazem Antenex NSC-77518 FT-0632135 Diazepam Dak Assival Paranten HMS503A15 Diazepam solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material BDBM50000766 Plidan Jinpanfan Diazepam-Lipuro BRD-K16508793-001-01-8 Q-Pam Relanium LA 111 Calmociteno Reliver 439-14-5 Lizan Centrazepam 7-chloro-1-methyl-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one Mentalium Diazetard CPD000058398 7-Chloro-1-methyl-5-phenyl-1H-benzo[e][1,4]diazepin-2(3H)-one MLS001424086 Domalium Desconet A826456 NCGC00260007-01 S.A. R.L Seduksen Sibazone Spectrum4_000576 Tox21_113071 Tranquo-puren Valeo Vanconin Winii AC-10561 Nervium DZP Diastat (TN) An-Ding Novazam Faustal Apaurin Oprea1_126223 Gradual Diazepam Fabra Azedipamin Paxel HY-17027 Diazepam [USAN:INN:BAN:JAN] Best [Pharaceutical] Pomin KBio3_002780 Diazepamu [Polish] BSPBio_003279 Quiatril 1-Methyl-5-phenyl-7-chloro-1,4-benzodiazepin-2-one La-Iii CAS-439-14-5 Ro 5-2807 53320-84-6 Mandro Diazepamum CHEBI:49575 7-Chloro-1-methyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one Methyldiazepinone Dipaz D00293 7-Chloro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one NC00247 DSSTox_CID_406 Diaceplex WY-3467 SAM001246536 Serenamin Sipam Stesolin Tranimul Umbrium Valium Vazepam Alboral NINDS_000967 Elcion CR Diatran Ansiolin NSC 169897 Freudal Diazepam 0.1 mg/ml in Methanol Armonil Pacitran HMS2051N04 Diazepam Nordic BCP23002 Placidox 2 IDI1_000967 Diazepam, United States Pharmacopeia (USP) Reference Standard BIDD:GT0105 Psychopax Kratium Calmaven Relaminal 2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-1-methyl-5-phenyl- Levium CCG-100997 7-chloro-1,3-dihydro-1-methyl-5-phenyl-2H -1,4-benzodiazepin-2-one MCULE-8990989144 Diazepan leo Chuansuan 7-Chloro-1-methyl-5-phenyl-1,4-benzodiazepin-2-one Metil Gobanal DivK1c_000967 DB00829 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one. NCGC00178168-03 DTXSID4020406 Diapam ZINC6427 Sedapam Setonil Sonacon Tensium Tranquase Usempax ap Valrelease Vivol Dupin Diaquel Amiprol Noan Eurosan Diazemuls Anxicalm NSC169897 Gewacalm Diazepam Desitin Atensine Parzam Horizon Diazepam solution, 1.0 mg/mL in methanol, analytical standard, for drug analysis Bensedin Plumiaz Kabivitrum Diazepam-ratiopharm Britazepam Q3JTX2Q7TU (Z)-7-chloro-1-methyl-5-phenyl-1H-benzo[e][1,4]diazepin-2(3H)-one LA III Calmod Renborin 5-24-04-00300 (Beilstein Handbook Reference) Lovium Cercine 7-Chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine Metamidol Dienpax CS-0653 7-chloro-1-methyl-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-2-one Mono (2-ethylhexyl) phthalate Doval Desloneg AAOVKJBEBIDNHE-UHFFFAOYSA-N Nellium S.a. r.l. Seduxen Sico Relax Spectrum5_001890 Tox21_113071_1 Tranquo-tablinen Valiquid Vatran WLN: T67 GNV JN IHJ CG G1 KR AC1L1EZE neurolytr il e-Pam Diastat Acudial Anlin Novo-Dipam Faustan Diazepam (intranasal, epilepsy) Apo-diazepam Ortopsique GTPL3364 Diazepam for system suitability, European Pharmacopoeia (EP) Reference Standard Baogin Paxum I06-0194 Diazepam [USAN:USP:INN:BAN:JAN] Betapam Pro pam KBioGR_001012 C-17931 Quievita 11100-37-1 Lamra Caudel Ro-52807 7 -chloro-1,3-dihydro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one Mandro-Zep Diazepamum [INN-Latin] 7-chloro-1-methyl-5-phenyl-1,3-dihydro-benzo[e][1,4]diazepin-2-one Methyldiazepinone (pharmaceutical) Dipezona D07JVL 7-Chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2(1H)-one NCGC00178168-01 DSSTox_GSID_20406 Dialag [ Show all ]
Inchi Key	AAOVKJBEBIDNHE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3
PubChem CID	3016
ChEMBL	CHEMBL12
IUPHAR	3364
BindingDB	50000766
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	7100.0 nM	PMID2566295	IUPHAR

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417