| Entry |
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| Name |
Teneligliptin hydrobromide (JAN) |
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| Formula |
(C22H30N6OS)2. 5HBr
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| Exact mass |
1252.0712
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| Mol weight |
1257.72
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| Structure |
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| Class |
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| Remark |
| Product (DG01283): | D09756<JP> |
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| Efficacy |
Antidiabetic, Dipeptidyl peptidase-4 (DPP-4) inhibitor |
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| Target |
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| Pathway |
| hsa04974 | Protein digestion and absorption |
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| Metabolism |
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| Interaction |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A10 DRUGS USED IN DIABETES
A10B BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
A10BH Dipeptidyl peptidase 4 (DPP-4) inhibitors
A10BH08 Teneligliptin
D11968 Teneligliptin hydrobromide (JAN)
Drug groups [BR:br08330]
Antidiabetic agent
DG02044 Hypoglycemic agent
DG01601 DPP-4 inhibitor
DG01283 Teneligliptin
D11968 Teneligliptin hydrobromide
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG01283 Teneligliptin
D11968 Teneligliptin hydrobromide
Metabolizing enzyme inhibitor
DG01645 CYP2D6 inhibitor
DG01283 Teneligliptin
D11968 Teneligliptin hydrobromide
DG02852 CYP3A/CYP3A4 inhibitor
DG01522 CYP3A4 inhibitor
DG01283 Teneligliptin
D11968 Teneligliptin hydrobromide
DG02951 FMO inhibitor
DG01283 Teneligliptin
D11968 Teneligliptin hydrobromide
Unclassified
DG03306 FMO substrate
DG03191 FMO1 substrate
DG01283 Teneligliptin
D11968 Teneligliptin hydrobromide
DG02950 FMO3 substrate
DG01283 Teneligliptin
D11968 Teneligliptin hydrobromide
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
Peptidyl-peptidases
DPP4 (CD26)
D11968 Teneligliptin hydrobromide (JAN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D11968
Drug groups [BR:br08330]
Antidiabetic agent
DG02044 Hypoglycemic agent
DG01601 DPP-4 inhibitor
DG01283 Teneligliptin
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG01283 Teneligliptin
Metabolizing enzyme inhibitor
DG01645 CYP2D6 inhibitor
DG01283 Teneligliptin
DG02852 CYP3A/CYP3A4 inhibitor
DG01522 CYP3A4 inhibitor
DG01283 Teneligliptin
DG02951 FMO inhibitor
DG01283 Teneligliptin
Unclassified
DG03306 FMO substrate
DG03191 FMO1 substrate
DG01283 Teneligliptin
DG02950 FMO3 substrate
DG01283 Teneligliptin
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 65
1 N1x N 18.7600 -13.2300
2 C1x C 17.3600 -13.2300
3 C1y C 16.9400 -14.5600
4 C1x C 18.0600 -15.4000
5 C1y C 19.1800 -14.5600
6 C5a C 20.3700 -15.2600
7 N1y N 21.5600 -14.5600
8 C1x C 23.3800 -13.2300
9 C1x C 21.9800 -13.2300
10 C1x C 22.6800 -15.4000
11 S2x S 23.8000 -14.5600
12 N1y N 15.7500 -15.2600
13 C1x C 14.5600 -14.5600
14 C1x C 13.3000 -15.2600
15 N1y N 13.3000 -16.6600
16 C1x C 14.4900 -17.3600
17 C1x C 15.7500 -16.6600
18 C8y C 12.1100 -17.3600
19 C8y C 10.2900 -18.6900
20 C8x C 11.6900 -18.6900
21 N4y N 10.9900 -16.5200
22 N5x N 9.8700 -17.3600
23 C8y C 10.9900 -15.1200
24 C8x C 12.1800 -14.4200
25 C8x C 12.1800 -13.0200
26 C8x C 10.9900 -12.3200
27 C8x C 9.8000 -13.0200
28 C8x C 9.8000 -14.4200
29 C1a C 9.4500 -19.8100
30 O5a O 20.3700 -16.6600
31 X Br 28.1400 -16.3800
32 N1x N 18.7600 -13.2300
33 C1x C 17.3600 -13.2300
34 C1y C 16.9400 -14.5600
35 C1x C 18.0600 -15.4000
36 C1y C 19.1800 -14.5600
37 C5a C 20.3700 -15.2600
38 N1y N 21.5600 -14.5600
39 C1x C 21.9800 -13.2300
40 C1x C 23.3800 -13.2300
41 S2x S 23.8000 -14.5600
42 C1x C 22.6800 -15.4000
43 O5a O 20.3700 -16.6600
44 N1y N 15.7500 -15.2600
45 C1x C 14.5600 -14.5600
46 C1x C 13.3000 -15.2600
47 N1y N 13.3000 -16.6600
48 C1x C 14.4900 -17.3600
49 C1x C 15.7500 -16.6600
50 C8y C 12.1100 -17.3600
51 C8x C 11.6900 -18.6900
52 C8y C 10.2900 -18.6900
53 N5x N 9.8700 -17.3600
54 N4y N 10.9900 -16.5200
55 C8y C 10.9900 -15.1200
56 C8x C 12.1800 -14.4200
57 C8x C 12.1800 -13.0200
58 C8x C 10.9900 -12.3200
59 C8x C 9.8000 -13.0200
60 C8x C 9.8000 -14.4200
61 C1a C 9.4500 -19.8100
62 X Br 28.1400 -16.3800
63 X Br 28.1400 -16.3800
64 X Br 28.1400 -16.3800
65 X Br 28.1400 -16.3800
BOND 68
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 5 6 1 #Down
7 6 7 1
8 8 9 1
9 9 7 1
10 7 10 1
11 10 11 1
12 8 11 1
13 3 12 1 #Down
14 12 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 12 17 1
20 15 18 1
21 19 20 1
22 20 18 2
23 18 21 1
24 21 22 1
25 19 22 2
26 21 23 1
27 23 24 2
28 24 25 1
29 25 26 2
30 26 27 1
31 27 28 2
32 23 28 1
33 19 29 1
34 6 30 2
35 32 33 1
36 33 34 1
37 34 35 1
38 35 36 1
39 32 36 1
40 36 37 1 #Down
41 37 38 1
42 40 39 1
43 39 38 1
44 38 42 1
45 42 41 1
46 40 41 1
47 34 44 1 #Down
48 44 45 1
49 45 46 1
50 46 47 1
51 47 48 1
52 48 49 1
53 44 49 1
54 47 50 1
55 52 51 1
56 51 50 2
57 50 54 1
58 54 53 1
59 52 53 2
60 54 55 1
61 55 56 2
62 56 57 1
63 57 58 2
64 58 59 1
65 59 60 2
66 55 60 1
67 52 61 1
68 37 43 2
BRACKET 1 7.7000 -20.5800 7.7000 -11.8300
1 24.2200 -11.8300 24.2200 -20.5800
1 2
ORIGINAL 1 1 2 3 4 5 6 7 9 8 11 10 30 12 13 14 15
1 16 17 18 20 19 22 21 23 24 25 26 27 28 29
REPEAT 1 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47
1 48 49 50 51 52 53 54 55 56 57 58 59 60 61
2 26.8100 -17.0100 26.8100 -15.7500
2 29.2600 -15.7500 29.2600 -17.0100
2 5
ORIGINAL 2 31
REPEAT 2 62 63 64 65
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