Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO4320 | Salinispora tropica | Species | Micromonosporaceae | Bacteria |
PMID[15916417] |
|||
NPO15076 | Salinispora arenicola | Species | Micromonosporaceae | Bacteria |
PMID[15916417] |
|||
NPO4320 | Salinispora tropica | Species | Micromonosporaceae | Bacteria |
PMID[19133779] |
|||
NPO4320 | Salinispora tropica | Species | Micromonosporaceae | Bacteria |
PMID[12548698] |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | IC50 | = | 8.2 | nM | 15916417 |
NPT71 | Cell Line | HEK293 | Homo sapiens | IC50 | = | 11 | nM | 15916417 |
NPT419 | Organism | Oryctolagus cuniculus | Oryctolagus cuniculus | IC50 | = | 2.6 | nM | 15916417 |
NPT419 | Organism | Oryctolagus cuniculus | Oryctolagus cuniculus | IC50 | = | 21 | nM | 15916417 |
NPT419 | Organism | Oryctolagus cuniculus | Oryctolagus cuniculus | IC50 | = | 430 | nM | 15916417 |
NPT2 | Others | Unspecified | IC50 | = | 2.5 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 26 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 330 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 2 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 59 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 2600 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 3.5 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 28 | nM | 18939815 | |
NPT2 | Others | Unspecified | IC50 | = | 430 | nM | 18939815 | |
NPT2 | Others | Unspecified | Ki | = | 23 | nM | 18939815 | |
NPT2 | Others | Unspecified | Ki | = | 97 | nM | 18939815 | |
NPT2 | Others | Unspecified | Ki | > | 1000 | nM | 18939815 | |
NPT2 | Others | Unspecified | Activity | = | 0.01 | /s | 18939815 | |
NPT2 | Others | Unspecified | Activity | = | 0.003 | /s | 18939815 | |
NPT2 | Others | Unspecified | Activity | > | 0.02 | /s | 18939815 | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | IC50 | <= | 0.002 | ug/ml | 19022674 |
NPT2 | Others | Unspecified | GI50 | < | 10 | nM | 19022674 | |
NPT2 | Others | Unspecified | IC50 | = | 4 | nM | 19133779 | |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | IC50 | = | 11 | nM | 19133779 |
NPT2 | Others | Unspecified | IC50 | = | 34 | nM | 19133779 | |
NPT2 | Others | Unspecified | IC50 | = | 364 | nM | 19133779 | |
NPT2 | Others | Unspecified | IC50 | = | 1.9 | nM | 19746976 | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | IC50 | = | 16 | nM | 19746976 |
NPT2 | Others | Unspecified | IC50 | = | 1.3 | nM | 21835627 | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | IC50 | = | 35 | nM | 21835627 |
NPT1185 | Individual Protein | Proteasome component C5 | Homo sapiens | IC50 | = | 430 | nM | 22978849 |
NPT1186 | Individual Protein | Proteasome Macropain subunit | Homo sapiens | IC50 | = | 28 | nM | 22978849 |
NPT1187 | Individual Protein | Proteasome Macropain subunit MB1 | Homo sapiens | IC50 | = | 3.5 | nM | 22978849 |
NPT2 | Others | Unspecified | IC50 | = | 460 | nM | 23541650 | |
NPT2 | Others | Unspecified | IC50 | = | 21 | nM | 23541650 | |
NPT2 | Others | Unspecified | IC50 | = | 2.6 | nM | 23541650 | |
NPT1188 | Organism | Plasmodium yoelii yoelii | Plasmodium yoelii yoelii | ED50 | = | 0.25 | mg/kg/day | 23587422 |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | EC50 | = | 11 | nM | 23587422 |
NPT1187 | Individual Protein | Proteasome Macropain subunit MB1 | Homo sapiens | IC50 | = | 22 | nM | 24269479 |
NPT2 | Others | Unspecified | IC50 | = | 460 | nM | 24534487 | |
NPT2 | Others | Unspecified | IC50 | = | 21 | nM | 24534487 | |
NPT2 | Others | Unspecified | IC50 | = | 2.6 | nM | 24534487 |
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 NPC12270 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 |
---|---|---|
0.9223 | High Similarity | NPC14537 |
0.9135 | High Similarity | NPC473252 |
0.8738 | High Similarity | NPC234542 |
0.8654 | High Similarity | NPC473224 |
0.8544 | High Similarity | NPC123141 |
0.8431 | Intermediate Similarity | NPC226513 |
0.7863 | Intermediate Similarity | NPC201968 |
0.7692 | Intermediate Similarity | NPC50694 |
0.6803 | Remote Similarity | NPC7797 |
0.6694 | Remote Similarity | NPC474725 |
0.6667 | Remote Similarity | NPC475800 |
0.6639 | Remote Similarity | NPC46764 |
0.6615 | Remote Similarity | NPC204639 |
0.6614 | Remote Similarity | NPC323532 |
0.6612 | Remote Similarity | NPC70235 |
0.6587 | Remote Similarity | NPC216335 |
0.6583 | Remote Similarity | NPC472615 |
0.6569 | Remote Similarity | NPC230889 |
0.6549 | Remote Similarity | NPC314500 |
0.6538 | Remote Similarity | NPC16709 |
0.6504 | Remote Similarity | NPC92829 |
0.65 | Remote Similarity | NPC259476 |
0.65 | Remote Similarity | NPC472616 |
0.6475 | Remote Similarity | NPC168733 |
0.6471 | Remote Similarity | NPC78189 |
0.6446 | Remote Similarity | NPC271269 |
0.6429 | Remote Similarity | NPC475712 |
0.6423 | Remote Similarity | NPC473578 |
0.6417 | Remote Similarity | NPC215988 |
0.6396 | Remote Similarity | NPC475753 |
0.6372 | Remote Similarity | NPC118193 |
0.6372 | Remote Similarity | NPC256902 |
0.6364 | Remote Similarity | NPC74035 |
0.6349 | Remote Similarity | NPC122404 |
0.6341 | Remote Similarity | NPC307903 |
0.6341 | Remote Similarity | NPC140251 |
0.6341 | Remote Similarity | NPC475150 |
0.6339 | Remote Similarity | NPC475405 |
0.633 | Remote Similarity | NPC474312 |
0.6311 | Remote Similarity | NPC154601 |
0.6303 | Remote Similarity | NPC233932 |
0.6299 | Remote Similarity | NPC24462 |
0.629 | Remote Similarity | NPC133729 |
0.6288 | Remote Similarity | NPC280498 |
0.6281 | Remote Similarity | NPC474563 |
0.627 | Remote Similarity | NPC469865 |
0.626 | Remote Similarity | NPC251330 |
0.625 | Remote Similarity | NPC184461 |
0.625 | Remote Similarity | NPC329869 |
0.6228 | Remote Similarity | NPC159369 |
0.6228 | Remote Similarity | NPC39290 |
0.6195 | Remote Similarity | NPC86005 |
0.6186 | Remote Similarity | NPC165332 |
0.6186 | Remote Similarity | NPC180722 |
0.6186 | Remote Similarity | NPC195645 |
0.6182 | Remote Similarity | NPC47135 |
0.6179 | Remote Similarity | NPC475918 |
0.6172 | Remote Similarity | NPC471645 |
0.6154 | Remote Similarity | NPC471121 |
0.6154 | Remote Similarity | NPC471118 |
0.6148 | Remote Similarity | NPC204556 |
0.6134 | Remote Similarity | NPC475438 |
0.6111 | Remote Similarity | NPC127578 |
0.6111 | Remote Similarity | NPC113012 |
0.6111 | Remote Similarity | NPC122926 |
0.6106 | Remote Similarity | NPC258824 |
0.6103 | Remote Similarity | NPC329919 |
0.6103 | Remote Similarity | NPC477793 |
0.6087 | Remote Similarity | NPC97577 |
0.6077 | Remote Similarity | NPC471120 |
0.6077 | Remote Similarity | NPC147707 |
0.6077 | Remote Similarity | NPC471117 |
0.6071 | Remote Similarity | NPC475732 |
0.6068 | Remote Similarity | NPC472613 |
0.6053 | Remote Similarity | NPC477959 |
0.6048 | Remote Similarity | NPC166115 |
0.6032 | Remote Similarity | NPC474891 |
0.6032 | Remote Similarity | NPC329305 |
0.6031 | Remote Similarity | NPC477555 |
0.6031 | Remote Similarity | NPC9714 |
0.6017 | Remote Similarity | NPC5418 |
0.6016 | Remote Similarity | NPC261750 |
0.6016 | Remote Similarity | NPC1111 |
0.6015 | Remote Similarity | NPC469515 |
0.6015 | Remote Similarity | NPC23963 |
0.6 | Remote Similarity | NPC4834 |
0.6 | Remote Similarity | NPC193386 |
0.6 | Remote Similarity | NPC469494 |
0.6 | Remote Similarity | NPC167380 |
0.5984 | Remote Similarity | NPC474873 |
0.5984 | Remote Similarity | NPC476290 |
0.5983 | Remote Similarity | NPC36491 |
0.597 | Remote Similarity | NPC80150 |
0.5966 | Remote Similarity | NPC54905 |
0.5966 | Remote Similarity | NPC314009 |
0.5963 | Remote Similarity | NPC11796 |
0.5963 | Remote Similarity | NPC218817 |
0.5962 | Remote Similarity | NPC199557 |
0.5954 | Remote Similarity | NPC316325 |
0.5954 | Remote Similarity | NPC477553 |
0.594 | Remote Similarity | NPC476815 |
0.5938 | Remote Similarity | NPC29501 |
0.5935 | Remote Similarity | NPC469598 |
0.5929 | Remote Similarity | NPC295799 |
0.5926 | Remote Similarity | NPC469514 |
0.592 | Remote Similarity | NPC101106 |
0.592 | Remote Similarity | NPC135216 |
0.5917 | Remote Similarity | NPC475503 |
0.5917 | Remote Similarity | NPC469369 |
0.5917 | Remote Similarity | NPC469528 |
0.5917 | Remote Similarity | NPC121857 |
0.5909 | Remote Similarity | NPC113363 |
0.5897 | Remote Similarity | NPC473448 |
0.5897 | Remote Similarity | NPC313670 |
0.5893 | Remote Similarity | NPC474252 |
0.5891 | Remote Similarity | NPC35069 |
0.5891 | Remote Similarity | NPC258711 |
0.5891 | Remote Similarity | NPC268327 |
0.5891 | Remote Similarity | NPC60432 |
0.5891 | Remote Similarity | NPC295444 |
0.5891 | Remote Similarity | NPC279383 |
0.5891 | Remote Similarity | NPC476269 |
0.5891 | Remote Similarity | NPC273215 |
0.5887 | Remote Similarity | NPC76999 |
0.5887 | Remote Similarity | NPC4620 |
0.5882 | Remote Similarity | NPC473314 |
0.5878 | Remote Similarity | NPC30196 |
0.5873 | Remote Similarity | NPC199107 |
0.5873 | Remote Similarity | NPC42590 |
0.5873 | Remote Similarity | NPC232969 |
0.5872 | Remote Similarity | NPC281296 |
0.5868 | Remote Similarity | NPC245521 |
0.5857 | Remote Similarity | NPC139585 |
0.5856 | Remote Similarity | NPC103634 |
0.5855 | Remote Similarity | NPC315809 |
0.5855 | Remote Similarity | NPC314050 |
0.5854 | Remote Similarity | NPC316250 |
0.5852 | Remote Similarity | NPC273185 |
0.5847 | Remote Similarity | NPC111114 |
0.5847 | Remote Similarity | NPC300312 |
0.5847 | Remote Similarity | NPC261607 |
0.5845 | Remote Similarity | NPC75318 |
0.5841 | Remote Similarity | NPC69469 |
0.584 | Remote Similarity | NPC475676 |
0.584 | Remote Similarity | NPC220964 |
0.584 | Remote Similarity | NPC119329 |
0.5833 | Remote Similarity | NPC60718 |
0.5833 | Remote Similarity | NPC476190 |
0.5833 | Remote Similarity | NPC188010 |
0.5833 | Remote Similarity | NPC6531 |
0.5827 | Remote Similarity | NPC287572 |
0.5827 | Remote Similarity | NPC471636 |
0.5826 | Remote Similarity | NPC477993 |
0.5826 | Remote Similarity | NPC478112 |
0.5826 | Remote Similarity | NPC116575 |
0.5826 | Remote Similarity | NPC477994 |
0.5821 | Remote Similarity | NPC310467 |
0.582 | Remote Similarity | NPC474952 |
0.582 | Remote Similarity | NPC152480 |
0.5818 | Remote Similarity | NPC121200 |
0.5818 | Remote Similarity | NPC469492 |
0.5816 | Remote Similarity | NPC314361 |
0.5812 | Remote Similarity | NPC52198 |
0.5812 | Remote Similarity | NPC117405 |
0.5806 | Remote Similarity | NPC474747 |
0.5806 | Remote Similarity | NPC128501 |
0.5806 | Remote Similarity | NPC477198 |
0.5804 | Remote Similarity | NPC472430 |
0.5804 | Remote Similarity | NPC145899 |
0.5804 | Remote Similarity | NPC191711 |
0.5802 | Remote Similarity | NPC476813 |
0.5802 | Remote Similarity | NPC470540 |
0.5802 | Remote Similarity | NPC476814 |
0.5798 | Remote Similarity | NPC476049 |
0.5794 | Remote Similarity | NPC167145 |
0.5794 | Remote Similarity | NPC326024 |
0.5789 | Remote Similarity | NPC109603 |
0.5789 | Remote Similarity | NPC201889 |
0.5789 | Remote Similarity | NPC474776 |
0.5789 | Remote Similarity | NPC93688 |
0.5789 | Remote Similarity | NPC106791 |
0.5785 | Remote Similarity | NPC473859 |
0.5782 | Remote Similarity | NPC475394 |
0.5782 | Remote Similarity | NPC475584 |
0.5782 | Remote Similarity | NPC475152 |
0.5781 | Remote Similarity | NPC24389 |
0.5776 | Remote Similarity | NPC472614 |
0.5772 | Remote Similarity | NPC54705 |
0.5772 | Remote Similarity | NPC474718 |
0.5769 | Remote Similarity | NPC66108 |
0.5769 | Remote Similarity | NPC95290 |
0.5769 | Remote Similarity | NPC189338 |
0.5766 | Remote Similarity | NPC477088 |
0.5766 | Remote Similarity | NPC313333 |
0.5766 | Remote Similarity | NPC314451 |
0.5766 | Remote Similarity | NPC313342 |
0.5766 | Remote Similarity | NPC475210 |
0.5766 | Remote Similarity | NPC314512 |
0.5766 | Remote Similarity | NPC469517 |
0.5763 | Remote Similarity | NPC478003 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC12270 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 |
---|---|---|---|
1.0 | High Similarity | NPD1719 | Phase 1 |
0.6504 | Remote Similarity | NPD6420 | Discontinued |
0.6504 | Remote Similarity | NPD6421 | Discontinued |
0.6403 | Remote Similarity | NPD6333 | Approved |
0.6403 | Remote Similarity | NPD6334 | Approved |
0.6348 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.6262 | Remote Similarity | NPD3732 | Approved |
0.6207 | Remote Similarity | NPD5778 | Approved |
0.6207 | Remote Similarity | NPD5779 | Approved |
0.6186 | Remote Similarity | NPD7839 | Suspended |
0.6182 | Remote Similarity | NPD7345 | Approved |
0.6091 | Remote Similarity | NPD5369 | Approved |
0.6087 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD6101 | Approved |
0.605 | Remote Similarity | NPD4228 | Discovery |
0.6029 | Remote Similarity | NPD8074 | Phase 3 |
0.5983 | Remote Similarity | NPD6411 | Approved |
0.5954 | Remote Similarity | NPD7500 | Approved |
0.592 | Remote Similarity | NPD4211 | Phase 1 |
0.5906 | Remote Similarity | NPD6413 | Approved |
0.5899 | Remote Similarity | NPD6914 | Discontinued |
0.5893 | Remote Similarity | NPD6435 | Approved |
0.5847 | Remote Similarity | NPD7983 | Approved |
0.5826 | Remote Similarity | NPD5786 | Approved |
0.5822 | Remote Similarity | NPD8384 | Approved |
0.5806 | Remote Similarity | NPD3653 | Clinical (unspecified phase) |
0.5804 | Remote Similarity | NPD1448 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD5766 | Clinical (unspecified phase) |
0.5766 | Remote Similarity | NPD8340 | Approved |
0.5766 | Remote Similarity | NPD8342 | Approved |
0.5766 | Remote Similarity | NPD8341 | Approved |
0.5766 | Remote Similarity | NPD8299 | Approved |
0.5752 | Remote Similarity | NPD4269 | Approved |
0.5752 | Remote Similarity | NPD4270 | Approved |
0.5725 | Remote Similarity | NPD1376 | Discontinued |
0.5725 | Remote Similarity | NPD8451 | Approved |
0.5714 | Remote Similarity | NPD5368 | Approved |
0.5714 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5702 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.5702 | Remote Similarity | NPD7154 | Phase 3 |
0.5692 | Remote Similarity | NPD2204 | Approved |
0.5692 | Remote Similarity | NPD7116 | Clinical (unspecified phase) |
0.5683 | Remote Similarity | NPD8448 | Approved |
0.5674 | Remote Similarity | NPD8391 | Approved |
0.5674 | Remote Similarity | NPD8390 | Approved |
0.5674 | Remote Similarity | NPD8392 | Approved |
0.563 | Remote Similarity | NPD7100 | Approved |
0.562 | Remote Similarity | NPD5282 | Discontinued |
0.5603 | Remote Similarity | NPD5363 | Approved |
PubChem CID   | 11347535 |
ChEMBL   | CHEMBL371405 |
ZINC   |
Molecular Weight:   | 313.11 |
ALogP:   | -0.1056 |
MLogP:   | 2.45 |
XLogP:   | 2.326 |
# Rotatable Bonds:   | 8 |
Polar Surface Area:   | 79.12 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 2 |
# Rings:   | 3 |
# Heavy Atoms:   | 21 |