Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT91 | Cell Line | KB | Homo sapiens | IC50 | > | 20 | ug/ml | 11087609 |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 0.0165 | ug/ml | 19836231 |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 0.142 | ug/ml | 10346950 |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | GI | = | 98.3 | % | PubChem BioAssay data set |
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 NPC219621 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 |
---|---|---|
0.9032 | High Similarity | NPC37792 |
0.8065 | Intermediate Similarity | NPC472827 |
0.7937 | Intermediate Similarity | NPC317778 |
0.7903 | Intermediate Similarity | NPC472830 |
0.7826 | Intermediate Similarity | NPC265789 |
0.7746 | Intermediate Similarity | NPC125828 |
0.7606 | Intermediate Similarity | NPC476904 |
0.7571 | Intermediate Similarity | NPC21773 |
0.746 | Intermediate Similarity | NPC470370 |
0.746 | Intermediate Similarity | NPC470369 |
0.7424 | Intermediate Similarity | NPC145715 |
0.7385 | Intermediate Similarity | NPC311809 |
0.7333 | Intermediate Similarity | NPC211322 |
0.7313 | Intermediate Similarity | NPC473959 |
0.7302 | Intermediate Similarity | NPC318036 |
0.7286 | Intermediate Similarity | NPC138409 |
0.7286 | Intermediate Similarity | NPC184919 |
0.7231 | Intermediate Similarity | NPC28755 |
0.7231 | Intermediate Similarity | NPC152211 |
0.7188 | Intermediate Similarity | NPC173815 |
0.7188 | Intermediate Similarity | NPC474415 |
0.7188 | Intermediate Similarity | NPC474457 |
0.7188 | Intermediate Similarity | NPC475696 |
0.7188 | Intermediate Similarity | NPC474528 |
0.7162 | Intermediate Similarity | NPC7214 |
0.7119 | Intermediate Similarity | NPC124851 |
0.7077 | Intermediate Similarity | NPC324944 |
0.7042 | Intermediate Similarity | NPC472831 |
0.7 | Intermediate Similarity | NPC17518 |
0.7 | Intermediate Similarity | NPC22765 |
0.697 | Remote Similarity | NPC475716 |
0.697 | Remote Similarity | NPC474455 |
0.697 | Remote Similarity | NPC474454 |
0.697 | Remote Similarity | NPC474420 |
0.6933 | Remote Similarity | NPC476308 |
0.6923 | Remote Similarity | NPC329782 |
0.6912 | Remote Similarity | NPC474086 |
0.6849 | Remote Similarity | NPC476329 |
0.6835 | Remote Similarity | NPC472312 |
0.6825 | Remote Similarity | NPC476679 |
0.6812 | Remote Similarity | NPC476682 |
0.6795 | Remote Similarity | NPC12035 |
0.678 | Remote Similarity | NPC86683 |
0.675 | Remote Similarity | NPC171639 |
0.6709 | Remote Similarity | NPC118329 |
0.6709 | Remote Similarity | NPC152039 |
0.6709 | Remote Similarity | NPC474122 |
0.6707 | Remote Similarity | NPC157479 |
0.6625 | Remote Similarity | NPC283277 |
0.6625 | Remote Similarity | NPC215474 |
0.6613 | Remote Similarity | NPC476681 |
0.6562 | Remote Similarity | NPC474416 |
0.6562 | Remote Similarity | NPC472828 |
0.6552 | Remote Similarity | NPC190232 |
0.6552 | Remote Similarity | NPC105246 |
0.6506 | Remote Similarity | NPC166458 |
0.65 | Remote Similarity | NPC241784 |
0.65 | Remote Similarity | NPC296337 |
0.65 | Remote Similarity | NPC114239 |
0.65 | Remote Similarity | NPC13991 |
0.6441 | Remote Similarity | NPC192529 |
0.6389 | Remote Similarity | NPC474456 |
0.6386 | Remote Similarity | NPC75810 |
0.6386 | Remote Similarity | NPC147513 |
0.6386 | Remote Similarity | NPC182106 |
0.6386 | Remote Similarity | NPC152684 |
0.6386 | Remote Similarity | NPC311769 |
0.6386 | Remote Similarity | NPC24733 |
0.6364 | Remote Similarity | NPC469770 |
0.6364 | Remote Similarity | NPC123194 |
0.6353 | Remote Similarity | NPC259252 |
0.6349 | Remote Similarity | NPC200129 |
0.6341 | Remote Similarity | NPC21667 |
0.6333 | Remote Similarity | NPC202189 |
0.6333 | Remote Similarity | NPC248411 |
0.6324 | Remote Similarity | NPC469769 |
0.6301 | Remote Similarity | NPC476135 |
0.6271 | Remote Similarity | NPC193180 |
0.623 | Remote Similarity | NPC49088 |
0.6207 | Remote Similarity | NPC84171 |
0.6197 | Remote Similarity | NPC474596 |
0.6197 | Remote Similarity | NPC472544 |
0.619 | Remote Similarity | NPC106990 |
0.6129 | Remote Similarity | NPC323445 |
0.6111 | Remote Similarity | NPC311164 |
0.6111 | Remote Similarity | NPC272732 |
0.6102 | Remote Similarity | NPC103290 |
0.6087 | Remote Similarity | NPC231129 |
0.6067 | Remote Similarity | NPC93027 |
0.6067 | Remote Similarity | NPC476753 |
0.6067 | Remote Similarity | NPC476752 |
0.6024 | Remote Similarity | NPC39966 |
0.6024 | Remote Similarity | NPC224072 |
0.6 | Remote Similarity | NPC82919 |
0.6 | Remote Similarity | NPC476754 |
0.6 | Remote Similarity | NPC21781 |
0.5977 | Remote Similarity | NPC34754 |
0.5976 | Remote Similarity | NPC250632 |
0.5972 | Remote Similarity | NPC477740 |
0.597 | Remote Similarity | NPC476683 |
0.5942 | Remote Similarity | NPC11130 |
0.5932 | Remote Similarity | NPC78551 |
0.5932 | Remote Similarity | NPC227632 |
0.5932 | Remote Similarity | NPC62086 |
0.593 | Remote Similarity | NPC56107 |
0.5915 | Remote Similarity | NPC176621 |
0.5909 | Remote Similarity | NPC473728 |
0.5909 | Remote Similarity | NPC249312 |
0.5904 | Remote Similarity | NPC257962 |
0.5904 | Remote Similarity | NPC90150 |
0.5902 | Remote Similarity | NPC109813 |
0.5902 | Remote Similarity | NPC60556 |
0.5902 | Remote Similarity | NPC86538 |
0.589 | Remote Similarity | NPC476559 |
0.5882 | Remote Similarity | NPC470893 |
0.5875 | Remote Similarity | NPC174803 |
0.5875 | Remote Similarity | NPC259989 |
0.587 | Remote Similarity | NPC476903 |
0.5862 | Remote Similarity | NPC297643 |
0.5862 | Remote Similarity | NPC229262 |
0.5862 | Remote Similarity | NPC139717 |
0.5857 | Remote Similarity | NPC60772 |
0.5851 | Remote Similarity | NPC275686 |
0.5833 | Remote Similarity | NPC469728 |
0.5833 | Remote Similarity | NPC471868 |
0.5833 | Remote Similarity | NPC60565 |
0.5821 | Remote Similarity | NPC127944 |
0.5806 | Remote Similarity | NPC140300 |
0.5806 | Remote Similarity | NPC167419 |
0.5789 | Remote Similarity | NPC118275 |
0.5781 | Remote Similarity | NPC178644 |
0.5775 | Remote Similarity | NPC309825 |
0.5753 | Remote Similarity | NPC283247 |
0.5745 | Remote Similarity | NPC140685 |
0.5738 | Remote Similarity | NPC177470 |
0.5738 | Remote Similarity | NPC473912 |
0.5733 | Remote Similarity | NPC92327 |
0.5733 | Remote Similarity | NPC176171 |
0.5732 | Remote Similarity | NPC79704 |
0.5714 | Remote Similarity | NPC475724 |
0.5698 | Remote Similarity | NPC471867 |
0.5692 | Remote Similarity | NPC17810 |
0.569 | Remote Similarity | NPC76145 |
0.569 | Remote Similarity | NPC190810 |
0.569 | Remote Similarity | NPC34764 |
0.5682 | Remote Similarity | NPC43308 |
0.5676 | Remote Similarity | NPC469662 |
0.5676 | Remote Similarity | NPC53276 |
0.5672 | Remote Similarity | NPC212905 |
0.567 | Remote Similarity | NPC90538 |
0.5658 | Remote Similarity | NPC176107 |
0.5652 | Remote Similarity | NPC243985 |
0.5652 | Remote Similarity | NPC280710 |
0.5645 | Remote Similarity | NPC227670 |
0.5645 | Remote Similarity | NPC141777 |
0.5645 | Remote Similarity | NPC166362 |
0.5641 | Remote Similarity | NPC472543 |
0.5638 | Remote Similarity | NPC474164 |
0.5625 | Remote Similarity | NPC474582 |
0.5616 | Remote Similarity | NPC477739 |
0.56 | Remote Similarity | NPC475812 |
0.56 | Remote Similarity | NPC469970 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC219621 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 |
---|---|---|---|
0.6552 | Remote Similarity | NPD1799 | Clinical (unspecified phase) |
0.64 | Remote Similarity | NPD5365 | Phase 2 |
0.6267 | Remote Similarity | NPD6939 | Phase 2 |
0.6267 | Remote Similarity | NPD6938 | Clinical (unspecified phase) |
0.5824 | Remote Similarity | NPD5771 | Approved |
0.5824 | Remote Similarity | NPD5769 | Clinical (unspecified phase) |
0.5814 | Remote Similarity | NPD2205 | Approved |
0.5814 | Remote Similarity | NPD2208 | Approved |
0.5692 | Remote Similarity | NPD8262 | Approved |
0.569 | Remote Similarity | NPD319 | Phase 1 |
0.5606 | Remote Similarity | NPD4834 | Discontinued |
PubChem CID   | 23425032 |
ChEMBL   | CHEMBL503265 |
ZINC   |
Molecular Weight:   | 231.20 |
ALogP:   | 0.0863 |
MLogP:   | 3.11 |
XLogP:   | 4.416 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 4.36 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 17 |