Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | ED50 | = | 4.63 | ug/ml | 24405813 |
NPT81 | Cell Line | A549 | Homo sapiens | ED50 | = | 5.48 | ug/ml | 22731892 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | ED50 | = | 4.45 | ug/ml | 19721071 |
NPT574 | Cell Line | XF498 | Homo sapiens | ED50 | = | 5.59 | ug/ml | 18986198 |
NPT148 | Cell Line | HCT-15 | Homo sapiens | ED50 | = | 5.9 | ug/ml | 23099099 |
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 NPC223195 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 |
---|---|---|
0.7419 | Intermediate Similarity | NPC225783 |
0.7419 | Intermediate Similarity | NPC236797 |
0.7419 | Intermediate Similarity | NPC163556 |
0.7419 | Intermediate Similarity | NPC112242 |
0.7419 | Intermediate Similarity | NPC147096 |
0.7419 | Intermediate Similarity | NPC185041 |
0.7419 | Intermediate Similarity | NPC24506 |
0.7188 | Intermediate Similarity | NPC126915 |
0.7188 | Intermediate Similarity | NPC122962 |
0.7143 | Intermediate Similarity | NPC216416 |
0.697 | Remote Similarity | NPC139131 |
0.697 | Remote Similarity | NPC66124 |
0.697 | Remote Similarity | NPC181516 |
0.697 | Remote Similarity | NPC319034 |
0.697 | Remote Similarity | NPC72324 |
0.697 | Remote Similarity | NPC205141 |
0.697 | Remote Similarity | NPC291158 |
0.697 | Remote Similarity | NPC185538 |
0.697 | Remote Similarity | NPC272998 |
0.697 | Remote Similarity | NPC1748 |
0.697 | Remote Similarity | NPC193062 |
0.6857 | Remote Similarity | NPC213767 |
0.6842 | Remote Similarity | NPC474361 |
0.6774 | Remote Similarity | NPC159845 |
0.6774 | Remote Similarity | NPC279895 |
0.6757 | Remote Similarity | NPC471282 |
0.6667 | Remote Similarity | NPC267243 |
0.6571 | Remote Similarity | NPC97967 |
0.6562 | Remote Similarity | NPC110884 |
0.6471 | Remote Similarity | NPC152759 |
0.6471 | Remote Similarity | NPC12231 |
0.6389 | Remote Similarity | NPC474914 |
0.6389 | Remote Similarity | NPC474392 |
0.6341 | Remote Similarity | NPC108195 |
0.6341 | Remote Similarity | NPC215358 |
0.6341 | Remote Similarity | NPC62014 |
0.6333 | Remote Similarity | NPC275462 |
0.6333 | Remote Similarity | NPC232554 |
0.6286 | Remote Similarity | NPC283682 |
0.625 | Remote Similarity | NPC149668 |
0.625 | Remote Similarity | NPC144829 |
0.6216 | Remote Similarity | NPC177022 |
0.6216 | Remote Similarity | NPC74352 |
0.6207 | Remote Similarity | NPC52403 |
0.6207 | Remote Similarity | NPC39977 |
0.6207 | Remote Similarity | NPC47161 |
0.619 | Remote Similarity | NPC473914 |
0.619 | Remote Similarity | NPC201948 |
0.619 | Remote Similarity | NPC269074 |
0.6129 | Remote Similarity | NPC560 |
0.6071 | Remote Similarity | NPC294703 |
0.6053 | Remote Similarity | NPC197039 |
0.6047 | Remote Similarity | NPC19834 |
0.6047 | Remote Similarity | NPC55063 |
0.6047 | Remote Similarity | NPC8597 |
0.6 | Remote Similarity | NPC245688 |
0.5952 | Remote Similarity | NPC474413 |
0.5952 | Remote Similarity | NPC473539 |
0.5926 | Remote Similarity | NPC34153 |
0.5926 | Remote Similarity | NPC311000 |
0.5897 | Remote Similarity | NPC225963 |
0.5897 | Remote Similarity | NPC221022 |
0.5897 | Remote Similarity | NPC474205 |
0.5862 | Remote Similarity | NPC299484 |
0.5862 | Remote Similarity | NPC110344 |
0.5862 | Remote Similarity | NPC88839 |
0.5854 | Remote Similarity | NPC31121 |
0.5854 | Remote Similarity | NPC304151 |
0.5814 | Remote Similarity | NPC276825 |
0.5806 | Remote Similarity | NPC213764 |
0.5778 | Remote Similarity | NPC304162 |
0.5778 | Remote Similarity | NPC248884 |
0.5778 | Remote Similarity | NPC85079 |
0.5778 | Remote Similarity | NPC31194 |
0.5769 | Remote Similarity | NPC227986 |
0.5769 | Remote Similarity | NPC273385 |
0.5769 | Remote Similarity | NPC64370 |
0.5769 | Remote Similarity | NPC136996 |
0.5769 | Remote Similarity | NPC302327 |
0.5769 | Remote Similarity | NPC82648 |
0.5769 | Remote Similarity | NPC278711 |
0.5758 | Remote Similarity | NPC52362 |
0.5758 | Remote Similarity | NPC238135 |
0.575 | Remote Similarity | NPC329762 |
0.575 | Remote Similarity | NPC27444 |
0.575 | Remote Similarity | NPC152008 |
0.575 | Remote Similarity | NPC103236 |
0.5714 | Remote Similarity | NPC262505 |
0.5714 | Remote Similarity | NPC163707 |
0.5714 | Remote Similarity | NPC261991 |
0.5714 | Remote Similarity | NPC179831 |
0.5714 | Remote Similarity | NPC49151 |
0.5714 | Remote Similarity | NPC272426 |
0.5714 | Remote Similarity | NPC254713 |
0.5682 | Remote Similarity | NPC180575 |
0.5652 | Remote Similarity | NPC474642 |
0.5652 | Remote Similarity | NPC249670 |
0.5652 | Remote Similarity | NPC473913 |
0.5652 | Remote Similarity | NPC72699 |
0.561 | Remote Similarity | NPC103286 |
0.561 | Remote Similarity | NPC163746 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC223195 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 |
---|---|---|---|
0.697 | Remote Similarity | NPD2272 | Approved |
0.697 | Remote Similarity | NPD5383 | Approved |
0.5926 | Remote Similarity | NPD8223 | Approved |
0.575 | Remote Similarity | NPD7536 | Approved |
0.5714 | Remote Similarity | NPD1461 | Approved |
0.5714 | Remote Similarity | NPD8224 | Approved |
0.5714 | Remote Similarity | NPD907 | Approved |
0.5714 | Remote Similarity | NPD908 | Approved |
PubChem CID   | 11816199 |
ChEMBL   | CHEMBL451481 |
ZINC   |
Molecular Weight:   | 178.14 |
ALogP:   | -0.5942 |
MLogP:   | 2.67 |
XLogP:   | 4.337 |
# Rotatable Bonds:   | 7 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 0 |
# Heavy Atoms:   | 13 |