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Name | Neurotensin receptor type 1 |
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Species | Rattus norvegicus (Rat) |
Gene | Ntsr1 |
Synonym | NTS1 receptor NTRH NTR1 NTR NT-R-1 [ Show all ] |
Disease | N/A for non-human GPCRs |
Length | 424 |
Amino acid sequence | MHLNSSVPQGTPGEPDAQPFSGPQSEMEATFLALSLSNGSGNTSESDTAGPNSDLDVNTDIYSKVLVTAIYLALFVVGTVGNSVTAFTLARKKSLQSLQSTVHYHLGSLALSDLLILLLAMPVELYNFIWVHHPWAFGDAGCRGYYFLRDACTYATALNVASLSVERYLAICHPFKAKTLMSRSRTKKFISAIWLASALLAIPMLFTMGLQNRSGDGTHPGGLVCTPIVDTATVKVVIQVNTFMSFLFPMLVISILNTVIANKLTVMVHQAAEQGRVCTVGTHNGLEHSTFNMTIEPGRVQALRHGVLVLRAVVIAFVVCWLPYHVRRLMFCYISDEQWTTFLFDFYHYFYMLTNALFYVSSAINPILYNLVSANFRQVFLSTLACLCPGWRHRRKKRPTFSRKPNSMSSNHAFSTSATRETLY |
UniProt | P20789 |
Protein Data Bank | 3zev, 4buo, 4bv0, 4bwb, 5t04 |
GPCR-HGmod model | N/A |
3D structure model | This structure is from PDB ID 3zev. |
BioLiP | BL0365097, BL0267346,BL0267350, BL0267315,BL0267316, BL0267314,BL0267317, BL0267354,BL0267355, BL0267356,BL0267357, BL0365096, BL0267347,BL0267348,BL0267349, |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL3027 |
IUPHAR | 309 |
DrugBank | N/A |
Name | CHEMBL1793837 |
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Molecular formula | C41H64N12O7 |
IUPAC name | (2S)-2-[[(2R,3R)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentyl]amino]-3-phenylpropanoic acid |
Molecular weight | 837.04 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 11 |
XlogP | -2.0 |
Synonyms | BDBM50369072 |
Inchi Key | QXGQKFWHFUGJDS-CPMVAYJASA-N |
Inchi ID | InChI=1S/C41H64N12O7/c1-3-25(2)33(24-49-32(39(59)60)23-26-10-5-4-6-11-26)52-36(56)31(22-27-15-17-28(54)18-16-27)51-37(57)34-14-9-21-53(34)38(58)30(13-8-20-48-41(45)46)50-35(55)29(42)12-7-19-47-40(43)44/h4-6,10-11,15-18,25,29-34,49,54H,3,7-9,12-14,19-24,42H2,1-2H3,(H,50,55)(H,51,57)(H,52,56)(H,59,60)(H4,43,44,47)(H4,45,46,48)/t25-,29+,30+,31+,32+,33+,34+/m1/s1 |
PubChem CID | 56675175 |
ChEMBL | CHEMBL1793837 |
IUPHAR | N/A |
BindingDB | 50369072 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 8000.0 nM | PMID7699693 | BindingDB,ChEMBL |
Relative potency | 0.1 - | PMID7699693 | ChEMBL |
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