Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT6254 | Individual Protein | Coagulation factor VII | Homo sapiens | Ki | = | 108 | nM | 15332844 |
NPT670 | Individual Protein | Thrombin | Homo sapiens | Ki | = | 452 | nM | 15332844 |
NPT6254 | Individual Protein | Coagulation factor VII | Homo sapiens | Ki | = | 110 | nM | 19447619 |
NPT670 | Individual Protein | Thrombin | Homo sapiens | Ki | = | 450 | nM | 19447619 |
NPT670 | Individual Protein | Thrombin | Homo sapiens | IC50 | = | 46 | nM | 19674897 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
●  The left chart: Distribution of similarity level between NPC477401 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).
Similarity Score | Similarity Level | Natural Product ID |
---|---|---|
1.0 | High Similarity | NPC477399 |
0.9612 | High Similarity | NPC477400 |
0.9085 | High Similarity | NPC477398 |
0.645 | Remote Similarity | NPC22883 |
0.645 | Remote Similarity | NPC217804 |
0.645 | Remote Similarity | NPC210377 |
0.645 | Remote Similarity | NPC5719 |
0.6419 | Remote Similarity | NPC470653 |
0.6419 | Remote Similarity | NPC470654 |
0.6419 | Remote Similarity | NPC470650 |
0.6374 | Remote Similarity | NPC63040 |
0.635 | Remote Similarity | NPC476877 |
0.6327 | Remote Similarity | NPC160688 |
0.6319 | Remote Similarity | NPC2501 |
0.6316 | Remote Similarity | NPC15068 |
0.6276 | Remote Similarity | NPC477121 |
0.6259 | Remote Similarity | NPC470652 |
0.6259 | Remote Similarity | NPC476876 |
0.625 | Remote Similarity | NPC197743 |
0.625 | Remote Similarity | NPC297145 |
0.6213 | Remote Similarity | NPC62104 |
0.6213 | Remote Similarity | NPC1390 |
0.6211 | Remote Similarity | NPC52748 |
0.6207 | Remote Similarity | NPC296043 |
0.6205 | Remote Similarity | NPC122590 |
0.6173 | Remote Similarity | NPC315266 |
0.617 | Remote Similarity | NPC207820 |
0.6164 | Remote Similarity | NPC329216 |
0.6154 | Remote Similarity | NPC476875 |
0.6149 | Remote Similarity | NPC142761 |
0.614 | Remote Similarity | NPC73655 |
0.6133 | Remote Similarity | NPC471255 |
0.6082 | Remote Similarity | NPC471527 |
0.6061 | Remote Similarity | NPC471821 |
0.6061 | Remote Similarity | NPC471820 |
0.6053 | Remote Similarity | NPC309525 |
0.6033 | Remote Similarity | NPC94862 |
0.6028 | Remote Similarity | NPC241394 |
0.6027 | Remote Similarity | NPC103391 |
0.6027 | Remote Similarity | NPC472536 |
0.6012 | Remote Similarity | NPC276822 |
0.6 | Remote Similarity | NPC315188 |
0.6 | Remote Similarity | NPC471260 |
0.6 | Remote Similarity | NPC119652 |
0.6 | Remote Similarity | NPC97526 |
0.5974 | Remote Similarity | NPC470651 |
0.5974 | Remote Similarity | NPC470655 |
0.5966 | Remote Similarity | NPC280022 |
0.5965 | Remote Similarity | NPC322372 |
0.5965 | Remote Similarity | NPC319334 |
0.5965 | Remote Similarity | NPC327517 |
0.5962 | Remote Similarity | NPC120335 |
0.596 | Remote Similarity | NPC471262 |
0.596 | Remote Similarity | NPC273185 |
0.5957 | Remote Similarity | NPC302715 |
0.5957 | Remote Similarity | NPC128303 |
0.5944 | Remote Similarity | NPC171734 |
0.5935 | Remote Similarity | NPC25327 |
0.5926 | Remote Similarity | NPC80514 |
0.5921 | Remote Similarity | NPC50520 |
0.592 | Remote Similarity | NPC471052 |
0.592 | Remote Similarity | NPC471051 |
0.592 | Remote Similarity | NPC471053 |
0.5914 | Remote Similarity | NPC102959 |
0.5886 | Remote Similarity | NPC130309 |
0.5882 | Remote Similarity | NPC60516 |
0.5882 | Remote Similarity | NPC36254 |
0.5872 | Remote Similarity | NPC321485 |
0.5872 | Remote Similarity | NPC317377 |
0.5862 | Remote Similarity | NPC251122 |
0.5858 | Remote Similarity | NPC162104 |
0.5849 | Remote Similarity | NPC471256 |
0.5844 | Remote Similarity | NPC471263 |
0.5843 | Remote Similarity | NPC262077 |
0.5833 | Remote Similarity | NPC477462 |
0.5818 | Remote Similarity | NPC476978 |
0.5816 | Remote Similarity | NPC471258 |
0.5813 | Remote Similarity | NPC82129 |
0.5797 | Remote Similarity | NPC47076 |
0.5797 | Remote Similarity | NPC134504 |
0.5782 | Remote Similarity | NPC478024 |
0.578 | Remote Similarity | NPC324850 |
0.5767 | Remote Similarity | NPC315848 |
0.5767 | Remote Similarity | NPC315210 |
0.5765 | Remote Similarity | NPC300443 |
0.5762 | Remote Similarity | NPC471261 |
0.5756 | Remote Similarity | NPC476268 |
0.5742 | Remote Similarity | NPC6975 |
0.5732 | Remote Similarity | NPC8325 |
0.5722 | Remote Similarity | NPC89831 |
0.5714 | Remote Similarity | NPC287401 |
0.5707 | Remote Similarity | NPC472999 |
0.5694 | Remote Similarity | NPC471259 |
0.5691 | Remote Similarity | NPC96275 |
0.5689 | Remote Similarity | NPC477519 |
0.5689 | Remote Similarity | NPC5620 |
0.5677 | Remote Similarity | NPC252878 |
0.5673 | Remote Similarity | NPC315809 |
0.5673 | Remote Similarity | NPC314050 |
0.5669 | Remote Similarity | NPC260270 |
0.5667 | Remote Similarity | NPC271115 |
0.5661 | Remote Similarity | NPC246591 |
0.566 | Remote Similarity | NPC261730 |
0.5659 | Remote Similarity | NPC26108 |
0.5658 | Remote Similarity | NPC477237 |
0.5641 | Remote Similarity | NPC46427 |
0.5638 | Remote Similarity | NPC469597 |
0.5636 | Remote Similarity | NPC163392 |
0.5636 | Remote Similarity | NPC239762 |
0.5634 | Remote Similarity | NPC188785 |
0.5632 | Remote Similarity | NPC316244 |
0.5632 | Remote Similarity | NPC51047 |
0.5621 | Remote Similarity | NPC311658 |
0.5621 | Remote Similarity | NPC145113 |
0.5621 | Remote Similarity | NPC139867 |
0.5613 | Remote Similarity | NPC202521 |
0.5611 | Remote Similarity | NPC129486 |
0.561 | Remote Similarity | NPC68865 |
0.5608 | Remote Similarity | NPC474431 |
0.5608 | Remote Similarity | NPC474411 |
0.5605 | Remote Similarity | NPC473249 |
0.5605 | Remote Similarity | NPC145149 |
0.5603 | Remote Similarity | NPC220234 |
0.5602 | Remote Similarity | NPC470728 |
0.5602 | Remote Similarity | NPC263493 |
0.5602 | Remote Similarity | NPC269398 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC477401 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).
Similarity Score | Similarity Level | Drug ID | Developmental Stage |
---|---|---|---|
0.6053 | Remote Similarity | NPD4816 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD6122 | Discontinued |
0.6 | Remote Similarity | NPD4782 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD6077 | Discontinued |
0.5901 | Remote Similarity | NPD8173 | Phase 2 |
0.5901 | Remote Similarity | NPD8172 | Phase 2 |
0.5867 | Remote Similarity | NPD2132 | Phase 3 |
0.5839 | Remote Similarity | NPD6935 | Phase 3 |
0.5839 | Remote Similarity | NPD6936 | Clinical (unspecified phase) |
0.5818 | Remote Similarity | NPD5341 | Clinical (unspecified phase) |
0.58 | Remote Similarity | NPD6918 | Phase 1 |
0.5776 | Remote Similarity | NPD4791 | Clinical (unspecified phase) |
0.5755 | Remote Similarity | NPD3715 | Approved |
0.5755 | Remote Similarity | NPD3714 | Approved |
0.5755 | Remote Similarity | NPD3713 | Approved |
0.5741 | Remote Similarity | NPD5767 | Discontinued |
0.5724 | Remote Similarity | NPD6693 | Phase 3 |
0.5714 | Remote Similarity | NPD8065 | Phase 2 |
0.569 | Remote Similarity | NPD7118 | Clinical (unspecified phase) |
0.568 | Remote Similarity | NPD8290 | Clinical (unspecified phase) |
0.5663 | Remote Similarity | NPD8076 | Discontinued |
0.5652 | Remote Similarity | NPD3632 | Clinical (unspecified phase) |
0.5621 | Remote Similarity | NPD1689 | Approved |
0.5612 | Remote Similarity | NPD7841 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD5725 | Approved |
0.561 | Remote Similarity | NPD6073 | Approved |
0.5605 | Remote Similarity | NPD7747 | Phase 1 |
0.5605 | Remote Similarity | NPD7746 | Phase 1 |
0.5603 | Remote Similarity | NPD4825 | Clinical (unspecified phase) |
PubChem CID   | 10439038 |
ChEMBL   | CHEMBL502639 |
ZINC   |
Molecular Weight:   | 632.28 |
ALogP:   | -4.1837 |
MLogP:   | 2.45 |
XLogP:   | -1.979 |
# Rotatable Bonds:   | 24 |
Polar Surface Area:   | 246.49 |
# H-Bond Aceptor:   | 15 |
# H-Bond Donor:   | 6 |
# Rings:   | 3 |
# Heavy Atoms:   | 43 |