Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Ratio IC50 | > | 2.3 | 22624550 | ||
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 8.46 | ug/ml | DrugMatrix in vitro pharmacology data |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | > | 10 | ug/ml | 23268606 |
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 NPC473912 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 |
---|---|---|
0.8409 | Intermediate Similarity | NPC49088 |
0.8222 | Intermediate Similarity | NPC323445 |
0.7727 | Intermediate Similarity | NPC177470 |
0.766 | Intermediate Similarity | NPC178644 |
0.7619 | Intermediate Similarity | NPC229262 |
0.7619 | Intermediate Similarity | NPC297643 |
0.7619 | Intermediate Similarity | NPC139717 |
0.7561 | Intermediate Similarity | NPC92224 |
0.7556 | Intermediate Similarity | NPC109813 |
0.7556 | Intermediate Similarity | NPC90506 |
0.7556 | Intermediate Similarity | NPC60556 |
0.7556 | Intermediate Similarity | NPC90803 |
0.7556 | Intermediate Similarity | NPC23145 |
0.7556 | Intermediate Similarity | NPC86538 |
0.75 | Intermediate Similarity | NPC473614 |
0.75 | Intermediate Similarity | NPC218918 |
0.75 | Intermediate Similarity | NPC144023 |
0.75 | Intermediate Similarity | NPC120926 |
0.7391 | Intermediate Similarity | NPC202189 |
0.7391 | Intermediate Similarity | NPC248411 |
0.7381 | Intermediate Similarity | NPC34764 |
0.7381 | Intermediate Similarity | NPC190810 |
0.7381 | Intermediate Similarity | NPC76145 |
0.7358 | Intermediate Similarity | NPC278550 |
0.7347 | Intermediate Similarity | NPC200129 |
0.7273 | Intermediate Similarity | NPC246165 |
0.7273 | Intermediate Similarity | NPC183670 |
0.7234 | Intermediate Similarity | NPC229403 |
0.7234 | Intermediate Similarity | NPC296337 |
0.7234 | Intermediate Similarity | NPC86683 |
0.7222 | Intermediate Similarity | NPC472830 |
0.7209 | Intermediate Similarity | NPC239039 |
0.7209 | Intermediate Similarity | NPC266298 |
0.7174 | Intermediate Similarity | NPC166362 |
0.7174 | Intermediate Similarity | NPC141777 |
0.7174 | Intermediate Similarity | NPC474118 |
0.7174 | Intermediate Similarity | NPC51762 |
0.7174 | Intermediate Similarity | NPC227670 |
0.7143 | Intermediate Similarity | NPC282119 |
0.7091 | Intermediate Similarity | NPC143834 |
0.7091 | Intermediate Similarity | NPC469321 |
0.7 | Intermediate Similarity | NPC206088 |
0.6939 | Remote Similarity | NPC124851 |
0.6875 | Remote Similarity | NPC114239 |
0.6875 | Remote Similarity | NPC13991 |
0.6875 | Remote Similarity | NPC241784 |
0.6829 | Remote Similarity | NPC213749 |
0.6818 | Remote Similarity | NPC45727 |
0.6818 | Remote Similarity | NPC48638 |
0.68 | Remote Similarity | NPC22765 |
0.68 | Remote Similarity | NPC17518 |
0.6727 | Remote Similarity | NPC55004 |
0.6727 | Remote Similarity | NPC49575 |
0.6727 | Remote Similarity | NPC267626 |
0.6667 | Remote Similarity | NPC470893 |
0.6667 | Remote Similarity | NPC123194 |
0.6607 | Remote Similarity | NPC469769 |
0.6607 | Remote Similarity | NPC30215 |
0.6596 | Remote Similarity | NPC190232 |
0.6596 | Remote Similarity | NPC105246 |
0.6585 | Remote Similarity | NPC3649 |
0.6585 | Remote Similarity | NPC471327 |
0.6585 | Remote Similarity | NPC100879 |
0.6552 | Remote Similarity | NPC274704 |
0.6538 | Remote Similarity | NPC27438 |
0.6538 | Remote Similarity | NPC471681 |
0.6522 | Remote Similarity | NPC227632 |
0.6522 | Remote Similarity | NPC62086 |
0.6522 | Remote Similarity | NPC78551 |
0.65 | Remote Similarity | NPC469326 |
0.65 | Remote Similarity | NPC261782 |
0.65 | Remote Similarity | NPC205618 |
0.65 | Remote Similarity | NPC183422 |
0.65 | Remote Similarity | NPC187619 |
0.6491 | Remote Similarity | NPC5698 |
0.6491 | Remote Similarity | NPC309825 |
0.6471 | Remote Similarity | NPC106990 |
0.6458 | Remote Similarity | NPC192529 |
0.6429 | Remote Similarity | NPC230823 |
0.6429 | Remote Similarity | NPC193695 |
0.6415 | Remote Similarity | NPC179169 |
0.6415 | Remote Similarity | NPC157781 |
0.6415 | Remote Similarity | NPC306195 |
0.6415 | Remote Similarity | NPC35519 |
0.6415 | Remote Similarity | NPC473728 |
0.6415 | Remote Similarity | NPC181255 |
0.6383 | Remote Similarity | NPC103290 |
0.6379 | Remote Similarity | NPC25853 |
0.6379 | Remote Similarity | NPC47840 |
0.6379 | Remote Similarity | NPC135648 |
0.6379 | Remote Similarity | NPC323153 |
0.6379 | Remote Similarity | NPC252809 |
0.6379 | Remote Similarity | NPC234264 |
0.6346 | Remote Similarity | NPC26960 |
0.6346 | Remote Similarity | NPC329773 |
0.6346 | Remote Similarity | NPC182102 |
0.6316 | Remote Similarity | NPC266295 |
0.6316 | Remote Similarity | NPC94991 |
0.6296 | Remote Similarity | NPC192962 |
0.629 | Remote Similarity | NPC136813 |
0.6271 | Remote Similarity | NPC213152 |
0.6271 | Remote Similarity | NPC63111 |
0.6271 | Remote Similarity | NPC475795 |
0.625 | Remote Similarity | NPC193180 |
0.625 | Remote Similarity | NPC20603 |
0.625 | Remote Similarity | NPC274396 |
0.6226 | Remote Similarity | NPC214584 |
0.6226 | Remote Similarity | NPC26906 |
0.6207 | Remote Similarity | NPC259261 |
0.619 | Remote Similarity | NPC66577 |
0.619 | Remote Similarity | NPC151719 |
0.619 | Remote Similarity | NPC167527 |
0.6182 | Remote Similarity | NPC63396 |
0.6182 | Remote Similarity | NPC202850 |
0.6167 | Remote Similarity | NPC124112 |
0.6167 | Remote Similarity | NPC474086 |
0.6167 | Remote Similarity | NPC165695 |
0.6167 | Remote Similarity | NPC474480 |
0.6167 | Remote Similarity | NPC279200 |
0.6154 | Remote Similarity | NPC17810 |
0.6111 | Remote Similarity | NPC177112 |
0.6111 | Remote Similarity | NPC68014 |
0.6111 | Remote Similarity | NPC71506 |
0.6098 | Remote Similarity | NPC138113 |
0.6098 | Remote Similarity | NPC123965 |
0.6098 | Remote Similarity | NPC115959 |
0.6094 | Remote Similarity | NPC162867 |
0.6094 | Remote Similarity | NPC61702 |
0.6094 | Remote Similarity | NPC144647 |
0.6071 | Remote Similarity | NPC469770 |
0.6066 | Remote Similarity | NPC475704 |
0.6066 | Remote Similarity | NPC140233 |
0.6066 | Remote Similarity | NPC287744 |
0.6066 | Remote Similarity | NPC473902 |
0.6066 | Remote Similarity | NPC309300 |
0.6042 | Remote Similarity | NPC188596 |
0.6034 | Remote Similarity | NPC10017 |
0.6034 | Remote Similarity | NPC475830 |
0.6 | Remote Similarity | NPC268564 |
0.6 | Remote Similarity | NPC474141 |
0.6 | Remote Similarity | NPC471781 |
0.6 | Remote Similarity | NPC210346 |
0.6 | Remote Similarity | NPC127944 |
0.6 | Remote Similarity | NPC476679 |
0.5968 | Remote Similarity | NPC477009 |
0.5968 | Remote Similarity | NPC238352 |
0.5952 | Remote Similarity | NPC60288 |
0.5926 | Remote Similarity | NPC244038 |
0.5909 | Remote Similarity | NPC41886 |
0.5902 | Remote Similarity | NPC211291 |
0.5902 | Remote Similarity | NPC133368 |
0.5893 | Remote Similarity | NPC95581 |
0.5882 | Remote Similarity | NPC210560 |
0.5882 | Remote Similarity | NPC24824 |
0.5882 | Remote Similarity | NPC165651 |
0.5873 | Remote Similarity | NPC92327 |
0.5873 | Remote Similarity | NPC176171 |
0.5873 | Remote Similarity | NPC162309 |
0.5873 | Remote Similarity | NPC272125 |
0.5873 | Remote Similarity | NPC135650 |
0.5862 | Remote Similarity | NPC470369 |
0.5862 | Remote Similarity | NPC475696 |
0.5862 | Remote Similarity | NPC474415 |
0.5862 | Remote Similarity | NPC470370 |
0.5862 | Remote Similarity | NPC474457 |
0.5862 | Remote Similarity | NPC11130 |
0.5862 | Remote Similarity | NPC474528 |
0.5846 | Remote Similarity | NPC297358 |
0.5821 | Remote Similarity | NPC469320 |
0.5821 | Remote Similarity | NPC300940 |
0.5818 | Remote Similarity | NPC40417 |
0.5818 | Remote Similarity | NPC294358 |
0.5806 | Remote Similarity | NPC212210 |
0.5789 | Remote Similarity | NPC275472 |
0.5789 | Remote Similarity | NPC223604 |
0.5789 | Remote Similarity | NPC218525 |
0.5781 | Remote Similarity | NPC472255 |
0.5781 | Remote Similarity | NPC176107 |
0.5781 | Remote Similarity | NPC472253 |
0.5778 | Remote Similarity | NPC182392 |
0.5769 | Remote Similarity | NPC195246 |
0.5769 | Remote Similarity | NPC22098 |
0.5769 | Remote Similarity | NPC8610 |
0.5769 | Remote Similarity | NPC276009 |
0.5769 | Remote Similarity | NPC262558 |
0.5763 | Remote Similarity | NPC60772 |
0.575 | Remote Similarity | NPC266539 |
0.575 | Remote Similarity | NPC266144 |
0.575 | Remote Similarity | NPC31891 |
0.575 | Remote Similarity | NPC287191 |
0.5741 | Remote Similarity | NPC32351 |
0.5738 | Remote Similarity | NPC219621 |
0.5714 | Remote Similarity | NPC165755 |
0.5714 | Remote Similarity | NPC14002 |
0.5714 | Remote Similarity | NPC19569 |
0.5714 | Remote Similarity | NPC45283 |
0.5714 | Remote Similarity | NPC34671 |
0.5714 | Remote Similarity | NPC296311 |
0.5714 | Remote Similarity | NPC23117 |
0.5692 | Remote Similarity | NPC22760 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC473912 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 |
---|---|---|---|
0.7381 | Intermediate Similarity | NPD319 | Phase 1 |
0.6596 | Remote Similarity | NPD1799 | Clinical (unspecified phase) |
0.6154 | Remote Similarity | NPD8262 | Approved |
0.5846 | Remote Similarity | NPD1673 | Approved |
0.5606 | Remote Similarity | NPD6923 | Approved |
0.5606 | Remote Similarity | NPD6922 | Approved |
PubChem CID   | 44566864 |
ChEMBL   | CHEMBL455046 |
ZINC   |
Molecular Weight:   | 204.19 |
ALogP:   | 2.6467 |
MLogP:   | 3.11 |
XLogP:   | 6.048 |
# Rotatable Bonds:   | 4 |
Polar Surface Area:   | 0 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 15 |