Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D0V8LG
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| Former ID |
DNC001446
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| Drug Name |
Tick anticoagulant peptide (TAP)
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent | Investigative | [535352] | ||
| Structure |
|
Download2D MOL |
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| Formula |
C63H111N11O12
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| Canonical SMILES |
CC=CCC(C)C(=O)C1C(=O)NC(C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N<br />(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1C)<br />C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C<br />)C(C)C
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| InChI |
1S/C63H111N11O12/c1-26-27-28-41(16)53(76)52-57(80)67-49(38(10)11)61(84)68(19)33-48(75)69(20)44(29-34(2)3)56(79)66-50(39(12)13)62(85)70(21)45(30-35(4)5)55(78)64-42(17)54(77)65-43(18)58(81)71(22)46(31-36(6)7)59(82)72(23)47(32-37(8)9)60(83)73(24)51(40(14)15)63(86)74(52)25/h26-27,34-47,49-52H,28-33H2,1-25H3,(H,64,78)(H,65,77)(H,66,79)(H,67,80)/b27-26+/t41-,42+,43-,44+,45+,46+,47+,49+,50+,51+,52+/m1/s1
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| InChIKey |
YJDYDFNKCBANTM-QCWCSKBGSA-N
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| CAS Number |
CAS 121584-18-7
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| PubChem Compound ID | |||||
| PubChem Substance ID |
13393, 629786, 8616835, 12014683, 14792638, 14939450, 39315469, 47207934, 53787223, 57358436, 80185225, 103756868, 113856125, 123120912, 126682516, 134338954, 134340628, 135029355, 136340329, 137262651, 160870061, 162201859, 163621062, 163686385, 164766082, 184547718, 223440908, 223656435, 226407940, 241376778, 251970981, 252110095, 252157735, 252216124, 252347722
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| Target and Pathway | |||||
| Target(s) | Coagulation factor Xa | Target Info | Inhibitor | [535352] | |
| KEGG Pathway | Complement and coagulation cascades | ||||
| PANTHER Pathway | Blood coagulation | ||||
| Pathway Interaction Database | Beta2 integrin cell surface interactions | ||||
| PathWhiz Pathway | Coagulation | ||||
| Reactome | Extrinsic Pathway of Fibrin Clot Formation | ||||
| Intrinsic Pathway of Fibrin Clot Formation | |||||
| Common Pathway of Fibrin Clot Formation | |||||
| Gamma-carboxylation of protein precursors | |||||
| Transport of gamma-carboxylated protein precursors from the endoplasmic reticulum to the Golgi apparatus | |||||
| Removal of aminoterminal propeptides from gamma-carboxylated proteins | |||||
| References | |||||
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