Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Ratio IC50 | > | 38.5 | 16942016 | ||
NPT2 | Others | Unspecified | Ratio IC50 | > | 82.6 | 22939698 | ||
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 0.52 | ug/ml | 8450319 |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 0.242 | ug/ml | DrugMatrix in vitro pharmacology data |
NPT91 | Cell Line | KB | Homo sapiens | IC50 | > | 20 | ug/ml | 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 NPC474416 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 |
---|---|---|
0.9388 | High Similarity | NPC476681 |
0.9245 | High Similarity | NPC474457 |
0.8909 | High Similarity | NPC474420 |
0.8909 | High Similarity | NPC474455 |
0.8909 | High Similarity | NPC474454 |
0.8889 | High Similarity | NPC474528 |
0.8889 | High Similarity | NPC474415 |
0.8889 | High Similarity | NPC475696 |
0.8571 | High Similarity | NPC475716 |
0.8033 | Intermediate Similarity | NPC474456 |
0.7959 | Intermediate Similarity | NPC193180 |
0.7833 | Intermediate Similarity | NPC474086 |
0.7755 | Intermediate Similarity | NPC103290 |
0.7719 | Intermediate Similarity | NPC318036 |
0.7586 | Intermediate Similarity | NPC173815 |
0.75 | Intermediate Similarity | NPC476679 |
0.75 | Intermediate Similarity | NPC127944 |
0.7458 | Intermediate Similarity | NPC324944 |
0.7407 | Intermediate Similarity | NPC22765 |
0.7368 | Intermediate Similarity | NPC476683 |
0.7255 | Intermediate Similarity | NPC190232 |
0.7255 | Intermediate Similarity | NPC105246 |
0.7241 | Intermediate Similarity | NPC469770 |
0.7213 | Intermediate Similarity | NPC317778 |
0.7091 | Intermediate Similarity | NPC17518 |
0.7049 | Intermediate Similarity | NPC28755 |
0.7049 | Intermediate Similarity | NPC152211 |
0.6909 | Remote Similarity | NPC124851 |
0.6863 | Remote Similarity | NPC62086 |
0.6863 | Remote Similarity | NPC78551 |
0.6863 | Remote Similarity | NPC227632 |
0.6852 | Remote Similarity | NPC86683 |
0.6792 | Remote Similarity | NPC192529 |
0.6774 | Remote Similarity | NPC472827 |
0.6667 | Remote Similarity | NPC123194 |
0.6618 | Remote Similarity | NPC138409 |
0.6618 | Remote Similarity | NPC184919 |
0.6562 | Remote Similarity | NPC219621 |
0.6406 | Remote Similarity | NPC311809 |
0.6364 | Remote Similarity | NPC476682 |
0.6364 | Remote Similarity | NPC202189 |
0.6349 | Remote Similarity | NPC469769 |
0.6324 | Remote Similarity | NPC476135 |
0.629 | Remote Similarity | NPC264779 |
0.6282 | Remote Similarity | NPC477289 |
0.6269 | Remote Similarity | NPC476737 |
0.6269 | Remote Similarity | NPC27243 |
0.625 | Remote Similarity | NPC296337 |
0.625 | Remote Similarity | NPC241784 |
0.625 | Remote Similarity | NPC114239 |
0.625 | Remote Similarity | NPC13991 |
0.6212 | Remote Similarity | NPC475755 |
0.6212 | Remote Similarity | NPC474027 |
0.6212 | Remote Similarity | NPC474435 |
0.6197 | Remote Similarity | NPC21773 |
0.6197 | Remote Similarity | NPC265789 |
0.619 | Remote Similarity | NPC470370 |
0.619 | Remote Similarity | NPC470369 |
0.6182 | Remote Similarity | NPC141777 |
0.6182 | Remote Similarity | NPC227670 |
0.6182 | Remote Similarity | NPC166362 |
0.6176 | Remote Similarity | NPC189917 |
0.6176 | Remote Similarity | NPC168824 |
0.6176 | Remote Similarity | NPC43300 |
0.6176 | Remote Similarity | NPC39462 |
0.6176 | Remote Similarity | NPC107704 |
0.6176 | Remote Similarity | NPC96812 |
0.6119 | Remote Similarity | NPC469662 |
0.6094 | Remote Similarity | NPC189290 |
0.6094 | Remote Similarity | NPC474769 |
0.6094 | Remote Similarity | NPC60772 |
0.6081 | Remote Similarity | NPC476308 |
0.6071 | Remote Similarity | NPC248411 |
0.6029 | Remote Similarity | NPC475812 |
0.6027 | Remote Similarity | NPC476904 |
0.6 | Remote Similarity | NPC142754 |
0.6 | Remote Similarity | NPC82477 |
0.6 | Remote Similarity | NPC296697 |
0.6 | Remote Similarity | NPC94192 |
0.6 | Remote Similarity | NPC39157 |
0.5972 | Remote Similarity | NPC476329 |
0.597 | Remote Similarity | NPC197238 |
0.597 | Remote Similarity | NPC145715 |
0.597 | Remote Similarity | NPC202118 |
0.5965 | Remote Similarity | NPC229403 |
0.5942 | Remote Similarity | NPC37792 |
0.5942 | Remote Similarity | NPC222366 |
0.5942 | Remote Similarity | NPC286669 |
0.5942 | Remote Similarity | NPC92327 |
0.5942 | Remote Similarity | NPC476039 |
0.5926 | Remote Similarity | NPC246165 |
0.5915 | Remote Similarity | NPC286814 |
0.5915 | Remote Similarity | NPC477857 |
0.5902 | Remote Similarity | NPC473728 |
0.5902 | Remote Similarity | NPC212905 |
0.5882 | Remote Similarity | NPC473959 |
0.5873 | Remote Similarity | NPC200258 |
0.5873 | Remote Similarity | NPC470893 |
0.5867 | Remote Similarity | NPC7214 |
0.5857 | Remote Similarity | NPC220210 |
0.5857 | Remote Similarity | NPC197805 |
0.5857 | Remote Similarity | NPC20181 |
0.5857 | Remote Similarity | NPC176107 |
0.5844 | Remote Similarity | NPC211322 |
0.5833 | Remote Similarity | NPC477856 |
0.5833 | Remote Similarity | NPC45296 |
0.5833 | Remote Similarity | NPC214770 |
0.5833 | Remote Similarity | NPC200129 |
0.5821 | Remote Similarity | NPC469728 |
0.5821 | Remote Similarity | NPC41160 |
0.5806 | Remote Similarity | NPC472828 |
0.5797 | Remote Similarity | NPC64123 |
0.5797 | Remote Similarity | NPC474768 |
0.5781 | Remote Similarity | NPC39068 |
0.5775 | Remote Similarity | NPC476288 |
0.5775 | Remote Similarity | NPC20610 |
0.5775 | Remote Similarity | NPC139785 |
0.5753 | Remote Similarity | NPC164045 |
0.5753 | Remote Similarity | NPC190035 |
0.5753 | Remote Similarity | NPC111234 |
0.5753 | Remote Similarity | NPC301226 |
0.5738 | Remote Similarity | NPC236623 |
0.5735 | Remote Similarity | NPC474596 |
0.5714 | Remote Similarity | NPC323005 |
0.5694 | Remote Similarity | NPC472831 |
0.5694 | Remote Similarity | NPC139397 |
0.5694 | Remote Similarity | NPC182815 |
0.5692 | Remote Similarity | NPC11130 |
0.569 | Remote Similarity | NPC49088 |
0.5676 | Remote Similarity | NPC330659 |
0.5676 | Remote Similarity | NPC211009 |
0.5676 | Remote Similarity | NPC195489 |
0.5676 | Remote Similarity | NPC161187 |
0.5676 | Remote Similarity | NPC279241 |
0.5676 | Remote Similarity | NPC36310 |
0.5676 | Remote Similarity | NPC474743 |
0.5676 | Remote Similarity | NPC472506 |
0.5676 | Remote Similarity | NPC244708 |
0.5676 | Remote Similarity | NPC474488 |
0.5672 | Remote Similarity | NPC176621 |
0.5667 | Remote Similarity | NPC17810 |
0.5652 | Remote Similarity | NPC169275 |
0.5652 | Remote Similarity | NPC101128 |
0.5652 | Remote Similarity | NPC52449 |
0.5652 | Remote Similarity | NPC68656 |
0.5634 | Remote Similarity | NPC193770 |
0.5616 | Remote Similarity | NPC282593 |
0.5616 | Remote Similarity | NPC307176 |
0.5616 | Remote Similarity | NPC251929 |
0.5616 | Remote Similarity | NPC260040 |
0.5616 | Remote Similarity | NPC475728 |
0.5616 | Remote Similarity | NPC40574 |
0.5616 | Remote Similarity | NPC35734 |
0.5616 | Remote Similarity | NPC265782 |
0.5616 | Remote Similarity | NPC2634 |
0.5616 | Remote Similarity | NPC159577 |
0.5614 | Remote Similarity | NPC90803 |
0.5614 | Remote Similarity | NPC23145 |
0.5614 | Remote Similarity | NPC60556 |
0.5614 | Remote Similarity | NPC86538 |
0.5614 | Remote Similarity | NPC90506 |
0.5614 | Remote Similarity | NPC474118 |
0.5614 | Remote Similarity | NPC51762 |
0.5614 | Remote Similarity | NPC109813 |
0.5606 | Remote Similarity | NPC472830 |
0.56 | Remote Similarity | NPC192638 |
0.56 | Remote Similarity | NPC25511 |
0.56 | Remote Similarity | NPC5046 |
0.56 | Remote Similarity | NPC211641 |
0.56 | Remote Similarity | NPC196358 |
0.56 | Remote Similarity | NPC308440 |
0.56 | Remote Similarity | NPC476736 |
0.56 | Remote Similarity | NPC145552 |
0.56 | Remote Similarity | NPC100334 |
0.56 | Remote Similarity | NPC254509 |
0.56 | Remote Similarity | NPC472503 |
0.56 | Remote Similarity | NPC62657 |
0.56 | Remote Similarity | NPC159497 |
0.56 | Remote Similarity | NPC49168 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC474416 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 |
---|---|---|---|
0.7255 | Intermediate Similarity | NPD1799 | Clinical (unspecified phase) |
0.6316 | Remote Similarity | NPD8028 | Phase 2 |
0.6286 | Remote Similarity | NPD6939 | Phase 2 |
0.6286 | Remote Similarity | NPD6938 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD871 | Approved |
0.5789 | Remote Similarity | NPD873 | Approved |
0.5775 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.5694 | Remote Similarity | NPD4137 | Phase 3 |
0.5667 | Remote Similarity | NPD8262 | Approved |
0.5616 | Remote Similarity | NPD4691 | Approved |
0.5616 | Remote Similarity | NPD4747 | Approved |
PubChem CID   | 44566843 |
ChEMBL   | CHEMBL467611 |
ZINC   |
Molecular Weight:   | 297.25 |
ALogP:   | 2.314 |
MLogP:   | 3.66 |
XLogP:   | 6.641 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 23.79 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 3 |
# Heavy Atoms:   | 22 |