KEGG   DRUG: D05996Help
Entry
D05996                      Drug                                   

Name
Talnetant hydrochloride (USAN)
Formula
C25H22N2O2. HCl
Exact mass
418.1448
Mol weight
418.9153
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of symptoms associated with bladder dysfunction (SABD), including urinary urgency, frequency and/or urinary incontinence [NK-3 receptor antagonist]
Target
tachykinin receptor 3 / neurokinin-3 antagonist [HSA:6870] [KO:K04224]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction  
 
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Tachykinin / neurokinin
    tachykinin receptor 3 / neurokinin-3 receptor
     Talnetant
      D05996  Talnetant hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 
204519-66-4
PubChem: 
LigandBox: 
KCF data Show

ATOM        30
            1   C8x C    36.5400  -28.4900
            2   C8x C    36.5400  -27.0900
            3   C8x C    37.7300  -26.3900
            4   C8y C    38.9900  -27.0900
            5   C8y C    38.9900  -28.4900
            6   C8x C    37.7300  -29.1900
            7   C8y C    40.1800  -26.3900
            8   C8y C    41.3700  -27.0900
            9   C8y C    41.3700  -28.4900
            10  N5x N    40.1800  -29.1900
            11  C5a C    40.1800  -24.9900
            12  C8y C    42.5600  -29.1900
            13  O1a O    42.5600  -26.3900
            14  C8x C    43.7500  -28.4900
            15  C8x C    45.0100  -29.1900
            16  C8x C    45.0100  -30.6600
            17  C8x C    43.8200  -31.3600
            18  C8x C    42.5600  -30.6600
            19  N1b N    41.3700  -24.2900
            20  O5a O    38.9900  -24.2900
            21  C1c C    41.3700  -22.8900
            22  C1b C    40.1800  -22.1900
            23  C1a C    38.9900  -22.8900
            24  C8y C    42.5600  -22.1900
            25  C8x C    42.5600  -20.7900
            26  C8x C    43.8200  -20.0900
            27  C8x C    45.0100  -20.7900
            28  C8x C    45.0100  -22.1900
            29  C8x C    43.8200  -22.8900
            30  X   Cl   49.0700  -26.5300
BOND        32
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    7  11 1
            13    9  12 1
            14    8  13 1
            15   12  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   12  18 1
            21   11  19 1
            22   11  20 2
            23   19  21 1
            24   21  22 1
            25   22  23 1
            26   24  25 2
            27   25  26 1
            28   26  27 2
            29   27  28 1
            30   28  29 2
            31   24  29 1
            32   21  24 1 #Up

» Japanese version   » Back

DBGET integrated database retrieval system