Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT3 | Individual Protein | Thioredoxin glutathione reductase | Schistosoma mansoni | Potency | = | 50118.7 | nM | PubChem BioAssay data set |
NPT2 | Others | Unspecified | Potency | 5804.8 | nM | PubChem BioAssay data set | ||
NPT64 | Individual Protein | ATPase family AAA domain-containing protein 5 | Homo sapiens | Potency | 20587.8 | nM | PubChem BioAssay data set | |
NPT135 | Individual Protein | Chromobox protein homolog 1 | Homo sapiens | Potency | 100000 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 10000 | nM | PubChem BioAssay data set | ||
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | Potency | 4147.5 | nM | PubChem BioAssay data set | |
NPT154 | Individual Protein | Mothers against decapentaplegic homolog 3 | Homo sapiens | Potency | 10000 | nM | PubChem BioAssay data set | |
NPT444 | Individual Protein | Ubiquitin carboxyl-terminal hydrolase 1 | Homo sapiens | Potency | 2238.7 | nM | 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 NPC215507 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 |
---|---|---|
0.7891 | Intermediate Similarity | NPC11379 |
0.7891 | Intermediate Similarity | NPC230849 |
0.7744 | Intermediate Similarity | NPC173173 |
0.7597 | Intermediate Similarity | NPC174463 |
0.7132 | Intermediate Similarity | NPC469999 |
0.7122 | Intermediate Similarity | NPC307165 |
0.7045 | Intermediate Similarity | NPC241294 |
0.7045 | Intermediate Similarity | NPC202722 |
0.7045 | Intermediate Similarity | NPC471846 |
0.7045 | Intermediate Similarity | NPC471845 |
0.7045 | Intermediate Similarity | NPC39041 |
0.6978 | Remote Similarity | NPC471086 |
0.6912 | Remote Similarity | NPC23963 |
0.6901 | Remote Similarity | NPC133089 |
0.6889 | Remote Similarity | NPC138534 |
0.6889 | Remote Similarity | NPC477986 |
0.6884 | Remote Similarity | NPC477985 |
0.6884 | Remote Similarity | NPC326386 |
0.6884 | Remote Similarity | NPC471087 |
0.6835 | Remote Similarity | NPC329401 |
0.6835 | Remote Similarity | NPC474371 |
0.6835 | Remote Similarity | NPC477987 |
0.6828 | Remote Similarity | NPC45813 |
0.6818 | Remote Similarity | NPC43648 |
0.6692 | Remote Similarity | NPC271562 |
0.6691 | Remote Similarity | NPC201889 |
0.6691 | Remote Similarity | NPC323168 |
0.6691 | Remote Similarity | NPC477989 |
0.6691 | Remote Similarity | NPC477990 |
0.6691 | Remote Similarity | NPC111162 |
0.6691 | Remote Similarity | NPC106791 |
0.6691 | Remote Similarity | NPC293550 |
0.6643 | Remote Similarity | NPC477988 |
0.6642 | Remote Similarity | NPC130124 |
0.6642 | Remote Similarity | NPC193471 |
0.6618 | Remote Similarity | NPC65045 |
0.6618 | Remote Similarity | NPC469997 |
0.6617 | Remote Similarity | NPC30911 |
0.6617 | Remote Similarity | NPC316984 |
0.6617 | Remote Similarity | NPC58281 |
0.6589 | Remote Similarity | NPC265094 |
0.6569 | Remote Similarity | NPC235625 |
0.6538 | Remote Similarity | NPC64168 |
0.6462 | Remote Similarity | NPC6271 |
0.6462 | Remote Similarity | NPC279833 |
0.6462 | Remote Similarity | NPC173690 |
0.6462 | Remote Similarity | NPC80439 |
0.6449 | Remote Similarity | NPC284656 |
0.6429 | Remote Similarity | NPC470000 |
0.6387 | Remote Similarity | NPC185590 |
0.6387 | Remote Similarity | NPC15440 |
0.6387 | Remote Similarity | NPC264958 |
0.6378 | Remote Similarity | NPC471843 |
0.637 | Remote Similarity | NPC181510 |
0.637 | Remote Similarity | NPC47857 |
0.637 | Remote Similarity | NPC120335 |
0.637 | Remote Similarity | NPC168758 |
0.6364 | Remote Similarity | NPC471844 |
0.6345 | Remote Similarity | NPC470539 |
0.6319 | Remote Similarity | NPC476951 |
0.6288 | Remote Similarity | NPC133420 |
0.6241 | Remote Similarity | NPC93179 |
0.6214 | Remote Similarity | NPC200412 |
0.6214 | Remote Similarity | NPC120599 |
0.6214 | Remote Similarity | NPC156336 |
0.6187 | Remote Similarity | NPC470538 |
0.6174 | Remote Similarity | NPC313348 |
0.6174 | Remote Similarity | NPC475987 |
0.6165 | Remote Similarity | NPC44514 |
0.6148 | Remote Similarity | NPC470535 |
0.6136 | Remote Similarity | NPC287638 |
0.6136 | Remote Similarity | NPC194750 |
0.6136 | Remote Similarity | NPC233274 |
0.6134 | Remote Similarity | NPC216090 |
0.6133 | Remote Similarity | NPC239252 |
0.6133 | Remote Similarity | NPC473703 |
0.6125 | Remote Similarity | NPC12124 |
0.6125 | Remote Similarity | NPC44200 |
0.6103 | Remote Similarity | NPC470536 |
0.6099 | Remote Similarity | NPC96731 |
0.6087 | Remote Similarity | NPC469466 |
0.6077 | Remote Similarity | NPC476344 |
0.6076 | Remote Similarity | NPC266697 |
0.6058 | Remote Similarity | NPC196073 |
0.6058 | Remote Similarity | NPC195435 |
0.6047 | Remote Similarity | NPC150041 |
0.6045 | Remote Similarity | NPC87919 |
0.6043 | Remote Similarity | NPC469597 |
0.6027 | Remote Similarity | NPC309525 |
0.6014 | Remote Similarity | NPC147635 |
0.6014 | Remote Similarity | NPC163693 |
0.5974 | Remote Similarity | NPC473955 |
0.5974 | Remote Similarity | NPC25025 |
0.5971 | Remote Similarity | NPC474497 |
0.5971 | Remote Similarity | NPC275100 |
0.5956 | Remote Similarity | NPC176773 |
0.5951 | Remote Similarity | NPC475342 |
0.5946 | Remote Similarity | NPC478136 |
0.594 | Remote Similarity | NPC474348 |
0.5933 | Remote Similarity | NPC315011 |
0.592 | Remote Similarity | NPC130436 |
0.592 | Remote Similarity | NPC469861 |
0.592 | Remote Similarity | NPC469860 |
0.5906 | Remote Similarity | NPC97861 |
0.5903 | Remote Similarity | NPC88190 |
0.5899 | Remote Similarity | NPC474411 |
0.5899 | Remote Similarity | NPC474431 |
0.589 | Remote Similarity | NPC42747 |
0.589 | Remote Similarity | NPC186339 |
0.5874 | Remote Similarity | NPC476952 |
0.584 | Remote Similarity | NPC78089 |
0.5839 | Remote Similarity | NPC26617 |
0.5833 | Remote Similarity | NPC472167 |
0.5828 | Remote Similarity | NPC161644 |
0.5827 | Remote Similarity | NPC470529 |
0.5827 | Remote Similarity | NPC470532 |
0.5827 | Remote Similarity | NPC470530 |
0.5827 | Remote Similarity | NPC469631 |
0.5827 | Remote Similarity | NPC469628 |
0.5827 | Remote Similarity | NPC471047 |
0.5827 | Remote Similarity | NPC470533 |
0.5827 | Remote Similarity | NPC469603 |
0.5827 | Remote Similarity | NPC475906 |
0.5827 | Remote Similarity | NPC470527 |
0.5827 | Remote Similarity | NPC469653 |
0.5827 | Remote Similarity | NPC470528 |
0.5827 | Remote Similarity | NPC470531 |
0.5822 | Remote Similarity | NPC192309 |
0.5821 | Remote Similarity | NPC128733 |
0.5821 | Remote Similarity | NPC110443 |
0.5821 | Remote Similarity | NPC133907 |
0.5821 | Remote Similarity | NPC46998 |
0.5821 | Remote Similarity | NPC188785 |
0.5821 | Remote Similarity | NPC185141 |
0.58 | Remote Similarity | NPC13071 |
0.5794 | Remote Similarity | NPC38576 |
0.5794 | Remote Similarity | NPC107787 |
0.5794 | Remote Similarity | NPC279859 |
0.5789 | Remote Similarity | NPC54843 |
0.5786 | Remote Similarity | NPC470534 |
0.5782 | Remote Similarity | NPC1538 |
0.5779 | Remote Similarity | NPC243902 |
0.5778 | Remote Similarity | NPC473289 |
0.5778 | Remote Similarity | NPC86077 |
0.5772 | Remote Similarity | NPC280903 |
0.5764 | Remote Similarity | NPC471673 |
0.5764 | Remote Similarity | NPC471109 |
0.5758 | Remote Similarity | NPC172998 |
0.5758 | Remote Similarity | NPC299396 |
0.5758 | Remote Similarity | NPC301596 |
0.5755 | Remote Similarity | NPC38154 |
0.5745 | Remote Similarity | NPC276995 |
0.5745 | Remote Similarity | NPC76660 |
0.5743 | Remote Similarity | NPC144625 |
0.5743 | Remote Similarity | NPC321197 |
0.5733 | Remote Similarity | NPC172823 |
0.5725 | Remote Similarity | NPC121825 |
0.5714 | Remote Similarity | NPC472162 |
0.5704 | Remote Similarity | NPC474742 |
0.5694 | Remote Similarity | NPC147707 |
0.5694 | Remote Similarity | NPC475323 |
0.5692 | Remote Similarity | NPC118844 |
0.5692 | Remote Similarity | NPC110875 |
0.5692 | Remote Similarity | NPC299808 |
0.5692 | Remote Similarity | NPC72183 |
0.5691 | Remote Similarity | NPC69271 |
0.5691 | Remote Similarity | NPC74673 |
0.5683 | Remote Similarity | NPC474099 |
0.5682 | Remote Similarity | NPC273197 |
0.5682 | Remote Similarity | NPC224689 |
0.5682 | Remote Similarity | NPC234339 |
0.568 | Remote Similarity | NPC475947 |
0.5676 | Remote Similarity | NPC316133 |
0.5676 | Remote Similarity | NPC318445 |
0.5667 | Remote Similarity | NPC317654 |
0.5667 | Remote Similarity | NPC11732 |
0.5667 | Remote Similarity | NPC470537 |
0.5667 | Remote Similarity | NPC96010 |
0.5659 | Remote Similarity | NPC32922 |
0.5658 | Remote Similarity | NPC478139 |
0.5658 | Remote Similarity | NPC469351 |
0.5649 | Remote Similarity | NPC469645 |
0.5649 | Remote Similarity | NPC120420 |
0.5649 | Remote Similarity | NPC469692 |
0.5643 | Remote Similarity | NPC101018 |
0.5635 | Remote Similarity | NPC115786 |
0.5633 | Remote Similarity | NPC281104 |
0.5625 | Remote Similarity | NPC52533 |
0.5625 | Remote Similarity | NPC30196 |
0.5621 | Remote Similarity | NPC316401 |
0.5621 | Remote Similarity | NPC90814 |
0.5621 | Remote Similarity | NPC189393 |
0.562 | Remote Similarity | NPC475945 |
0.562 | Remote Similarity | NPC199831 |
0.562 | Remote Similarity | NPC474828 |
0.562 | Remote Similarity | NPC475871 |
0.562 | Remote Similarity | NPC68001 |
0.562 | Remote Similarity | NPC474827 |
0.5615 | Remote Similarity | NPC476019 |
0.5615 | Remote Similarity | NPC159568 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC215507 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 |
---|---|---|---|
0.6617 | Remote Similarity | NPD2204 | Approved |
0.6154 | Remote Similarity | NPD8080 | Discontinued |
0.6084 | Remote Similarity | NPD8274 | Clinical (unspecified phase) |
0.5933 | Remote Similarity | NPD2101 | Approved |
0.5929 | Remote Similarity | NPD1376 | Discontinued |
0.5839 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.5804 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD6845 | Suspended |
0.5733 | Remote Similarity | NPD8337 | Approved |
0.5733 | Remote Similarity | NPD8336 | Approved |
0.5724 | Remote Similarity | NPD2132 | Phase 3 |
0.5676 | Remote Similarity | NPD7642 | Approved |
0.5633 | Remote Similarity | NPD2569 | Approved |
0.5633 | Remote Similarity | NPD2567 | Approved |
0.5613 | Remote Similarity | NPD8415 | Approved |
PubChem CID   | 6426911 |
ChEMBL   | CHEMBL1394235 |
ZINC   |
Molecular Weight:   | 415.20 |
ALogP:   | 0.0468 |
MLogP:   | 3.22 |
XLogP:   | 0.956 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 82.14 |
# H-Bond Aceptor:   | 7 |
# H-Bond Donor:   | 0 |
# Rings:   | 5 |
# Heavy Atoms:   | 30 |