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 | 11858756 |
NPT2 | Others | Unspecified | IC50 | > | 20 | ug/ml | 11858756 | |
NPT485 | Organism | Plasmodium falciparum (isolate K1 / Thailand) | Plasmodium falciparum K1 | IC50 | = | 3.1 | ug/ml | 25237727 |
NPT1460 | Cell Line | L929 | Mus musculus | IC50 | = | 0.9 | ug/ml | 22940450 |
NPT639 | Cell Line | NCI-H187 | Homo sapiens | IC50 | = | 0.67 | ug/ml | 8027972 |
NPT189 | Cell Line | Vero | Chlorocebus aethiops | IC50 | = | 1.1 | ug/ml | 15771425 |
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 NPC260852 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 |
---|---|---|
0.8442 | Intermediate Similarity | NPC133873 |
0.7865 | Intermediate Similarity | NPC22376 |
0.7765 | Intermediate Similarity | NPC80622 |
0.7701 | Intermediate Similarity | NPC471340 |
0.7692 | Intermediate Similarity | NPC197107 |
0.7527 | Intermediate Similarity | NPC470187 |
0.75 | Intermediate Similarity | NPC126969 |
0.7468 | Intermediate Similarity | NPC469328 |
0.7447 | Intermediate Similarity | NPC39453 |
0.7419 | Intermediate Similarity | NPC472468 |
0.7416 | Intermediate Similarity | NPC242016 |
0.7391 | Intermediate Similarity | NPC299527 |
0.7386 | Intermediate Similarity | NPC472465 |
0.7342 | Intermediate Similarity | NPC165069 |
0.7317 | Intermediate Similarity | NPC254845 |
0.7312 | Intermediate Similarity | NPC472466 |
0.7294 | Intermediate Similarity | NPC170148 |
0.7263 | Intermediate Similarity | NPC472467 |
0.7262 | Intermediate Similarity | NPC190859 |
0.7253 | Intermediate Similarity | NPC145245 |
0.7245 | Intermediate Similarity | NPC471381 |
0.7229 | Intermediate Similarity | NPC41886 |
0.7216 | Intermediate Similarity | NPC182811 |
0.7215 | Intermediate Similarity | NPC199937 |
0.7209 | Intermediate Similarity | NPC476703 |
0.7188 | Intermediate Similarity | NPC240838 |
0.716 | Intermediate Similarity | NPC161612 |
0.716 | Intermediate Similarity | NPC33583 |
0.7158 | Intermediate Similarity | NPC475488 |
0.7143 | Intermediate Similarity | NPC45125 |
0.7143 | Intermediate Similarity | NPC476709 |
0.7143 | Intermediate Similarity | NPC143576 |
0.7143 | Intermediate Similarity | NPC274458 |
0.7113 | Intermediate Similarity | NPC98165 |
0.7108 | Intermediate Similarity | NPC471781 |
0.7097 | Intermediate Similarity | NPC148534 |
0.7093 | Intermediate Similarity | NPC329626 |
0.7093 | Intermediate Similarity | NPC472472 |
0.7071 | Intermediate Similarity | NPC186861 |
0.7053 | Intermediate Similarity | NPC235051 |
0.7041 | Intermediate Similarity | NPC476057 |
0.7041 | Intermediate Similarity | NPC347923 |
0.7041 | Intermediate Similarity | NPC261807 |
0.7033 | Intermediate Similarity | NPC116613 |
0.7021 | Intermediate Similarity | NPC22918 |
0.7011 | Intermediate Similarity | NPC471454 |
0.701 | Intermediate Similarity | NPC30477 |
0.701 | Intermediate Similarity | NPC220221 |
0.701 | Intermediate Similarity | NPC473348 |
0.701 | Intermediate Similarity | NPC472873 |
0.6989 | Remote Similarity | NPC258501 |
0.6979 | Remote Similarity | NPC137461 |
0.6979 | Remote Similarity | NPC258216 |
0.6979 | Remote Similarity | NPC98193 |
0.697 | Remote Similarity | NPC79449 |
0.697 | Remote Similarity | NPC474957 |
0.6966 | Remote Similarity | NPC117137 |
0.6966 | Remote Similarity | NPC66766 |
0.6962 | Remote Similarity | NPC15152 |
0.6951 | Remote Similarity | NPC308522 |
0.6951 | Remote Similarity | NPC74885 |
0.6941 | Remote Similarity | NPC14352 |
0.6941 | Remote Similarity | NPC234527 |
0.6939 | Remote Similarity | NPC103165 |
0.6939 | Remote Similarity | NPC210717 |
0.6939 | Remote Similarity | NPC284063 |
0.6932 | Remote Similarity | NPC477089 |
0.6931 | Remote Similarity | NPC200672 |
0.6931 | Remote Similarity | NPC214714 |
0.6915 | Remote Similarity | NPC473436 |
0.6914 | Remote Similarity | NPC250836 |
0.6907 | Remote Similarity | NPC473258 |
0.69 | Remote Similarity | NPC79631 |
0.6897 | Remote Similarity | NPC293223 |
0.6897 | Remote Similarity | NPC310643 |
0.6893 | Remote Similarity | NPC54737 |
0.6889 | Remote Similarity | NPC471661 |
0.6882 | Remote Similarity | NPC171484 |
0.6882 | Remote Similarity | NPC477668 |
0.6882 | Remote Similarity | NPC149018 |
0.6882 | Remote Similarity | NPC255143 |
0.6875 | Remote Similarity | NPC114389 |
0.6875 | Remote Similarity | NPC474699 |
0.6875 | Remote Similarity | NPC155215 |
0.6869 | Remote Similarity | NPC311904 |
0.6869 | Remote Similarity | NPC471150 |
0.6869 | Remote Similarity | NPC86843 |
0.6869 | Remote Similarity | NPC181151 |
0.6863 | Remote Similarity | NPC329834 |
0.686 | Remote Similarity | NPC309178 |
0.6854 | Remote Similarity | NPC476701 |
0.6848 | Remote Similarity | NPC86238 |
0.6832 | Remote Similarity | NPC26557 |
0.6827 | Remote Similarity | NPC469959 |
0.6827 | Remote Similarity | NPC469957 |
0.6827 | Remote Similarity | NPC108682 |
0.6827 | Remote Similarity | NPC472263 |
0.6818 | Remote Similarity | NPC186109 |
0.6804 | Remote Similarity | NPC475788 |
0.6804 | Remote Similarity | NPC296620 |
0.68 | Remote Similarity | NPC309493 |
0.6796 | Remote Similarity | NPC474464 |
0.6786 | Remote Similarity | NPC144647 |
0.6782 | Remote Similarity | NPC36479 |
0.6782 | Remote Similarity | NPC313185 |
0.6774 | Remote Similarity | NPC474349 |
0.6774 | Remote Similarity | NPC474189 |
0.6771 | Remote Similarity | NPC470832 |
0.6771 | Remote Similarity | NPC216284 |
0.6771 | Remote Similarity | NPC35809 |
0.6765 | Remote Similarity | NPC475956 |
0.6765 | Remote Similarity | NPC475986 |
0.6765 | Remote Similarity | NPC252242 |
0.6762 | Remote Similarity | NPC117604 |
0.6747 | Remote Similarity | NPC477791 |
0.6742 | Remote Similarity | NPC52755 |
0.6739 | Remote Similarity | NPC477667 |
0.6739 | Remote Similarity | NPC128246 |
0.6739 | Remote Similarity | NPC320548 |
0.6739 | Remote Similarity | NPC111409 |
0.6733 | Remote Similarity | NPC471242 |
0.6733 | Remote Similarity | NPC471247 |
0.6733 | Remote Similarity | NPC91497 |
0.6731 | Remote Similarity | NPC474015 |
0.6731 | Remote Similarity | NPC265502 |
0.6731 | Remote Similarity | NPC93026 |
0.6731 | Remote Similarity | NPC29389 |
0.6731 | Remote Similarity | NPC469960 |
0.6731 | Remote Similarity | NPC44004 |
0.6709 | Remote Similarity | NPC475968 |
0.6709 | Remote Similarity | NPC310228 |
0.6709 | Remote Similarity | NPC52431 |
0.6707 | Remote Similarity | NPC300442 |
0.6703 | Remote Similarity | NPC126248 |
0.6702 | Remote Similarity | NPC121981 |
0.6701 | Remote Similarity | NPC293001 |
0.6701 | Remote Similarity | NPC57304 |
0.6701 | Remote Similarity | NPC276298 |
0.6701 | Remote Similarity | NPC171360 |
0.6701 | Remote Similarity | NPC63193 |
0.6701 | Remote Similarity | NPC35959 |
0.6701 | Remote Similarity | NPC133888 |
0.6701 | Remote Similarity | NPC29821 |
0.67 | Remote Similarity | NPC470684 |
0.67 | Remote Similarity | NPC470683 |
0.6699 | Remote Similarity | NPC260809 |
0.6699 | Remote Similarity | NPC475701 |
0.6699 | Remote Similarity | NPC474783 |
0.6699 | Remote Similarity | NPC232515 |
0.6698 | Remote Similarity | NPC59489 |
0.6698 | Remote Similarity | NPC128133 |
0.6698 | Remote Similarity | NPC139838 |
0.6667 | Remote Similarity | NPC93869 |
0.6667 | Remote Similarity | NPC259296 |
0.6667 | Remote Similarity | NPC144486 |
0.6667 | Remote Similarity | NPC471659 |
0.6667 | Remote Similarity | NPC155935 |
0.6667 | Remote Similarity | NPC167527 |
0.6667 | Remote Similarity | NPC98276 |
0.6667 | Remote Similarity | NPC49783 |
0.6667 | Remote Similarity | NPC215556 |
0.6667 | Remote Similarity | NPC216911 |
0.6667 | Remote Similarity | NPC6765 |
0.6667 | Remote Similarity | NPC476228 |
0.6667 | Remote Similarity | NPC476053 |
0.6667 | Remote Similarity | NPC255882 |
0.6667 | Remote Similarity | NPC305698 |
0.6667 | Remote Similarity | NPC50435 |
0.6667 | Remote Similarity | NPC5604 |
0.6667 | Remote Similarity | NPC476896 |
0.6667 | Remote Similarity | NPC471112 |
0.6667 | Remote Similarity | NPC470168 |
0.6667 | Remote Similarity | NPC224532 |
0.6667 | Remote Similarity | NPC256567 |
0.6635 | Remote Similarity | NPC471111 |
0.6635 | Remote Similarity | NPC475331 |
0.6635 | Remote Similarity | NPC121518 |
0.6635 | Remote Similarity | NPC475335 |
0.6635 | Remote Similarity | NPC103298 |
0.6635 | Remote Similarity | NPC80809 |
0.6635 | Remote Similarity | NPC288502 |
0.6635 | Remote Similarity | NPC181104 |
0.6635 | Remote Similarity | NPC201144 |
0.6634 | Remote Similarity | NPC221615 |
0.6633 | Remote Similarity | NPC26046 |
0.6633 | Remote Similarity | NPC119379 |
0.663 | Remote Similarity | NPC212340 |
0.6628 | Remote Similarity | NPC469343 |
0.6627 | Remote Similarity | NPC162309 |
0.6625 | Remote Similarity | NPC162109 |
0.6602 | Remote Similarity | NPC31085 |
0.6602 | Remote Similarity | NPC470972 |
0.66 | Remote Similarity | NPC169270 |
0.66 | Remote Similarity | NPC111834 |
0.66 | Remote Similarity | NPC306797 |
0.66 | Remote Similarity | NPC72204 |
0.66 | Remote Similarity | NPC292718 |
0.6598 | Remote Similarity | NPC54065 |
0.6598 | Remote Similarity | NPC246173 |
0.6598 | Remote Similarity | NPC297474 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC260852 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 |
---|---|---|---|
0.6989 | Remote Similarity | NPD7524 | Approved |
0.6848 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6739 | Remote Similarity | NPD6695 | Phase 3 |
0.6593 | Remote Similarity | NPD6931 | Approved |
0.6593 | Remote Similarity | NPD6930 | Phase 2 |
0.6484 | Remote Similarity | NPD6929 | Approved |
0.6458 | Remote Similarity | NPD7750 | Discontinued |
0.6354 | Remote Similarity | NPD4249 | Approved |
0.6333 | Remote Similarity | NPD6933 | Approved |
0.6289 | Remote Similarity | NPD4251 | Approved |
0.6289 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6289 | Remote Similarity | NPD4250 | Approved |
0.6264 | Remote Similarity | NPD5776 | Phase 2 |
0.6264 | Remote Similarity | NPD6925 | Approved |
0.625 | Remote Similarity | NPD6893 | Approved |
0.6237 | Remote Similarity | NPD7514 | Phase 3 |
0.62 | Remote Similarity | NPD7087 | Discontinued |
0.6196 | Remote Similarity | NPD7145 | Approved |
0.6182 | Remote Similarity | NPD6371 | Approved |
0.617 | Remote Similarity | NPD6902 | Approved |
0.617 | Remote Similarity | NPD4790 | Discontinued |
0.6111 | Remote Similarity | NPD6924 | Approved |
0.6111 | Remote Similarity | NPD6926 | Approved |
0.6087 | Remote Similarity | NPD6932 | Approved |
0.6064 | Remote Similarity | NPD4819 | Approved |
0.6064 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.6064 | Remote Similarity | NPD7332 | Phase 2 |
0.6064 | Remote Similarity | NPD4822 | Approved |
0.6064 | Remote Similarity | NPD4821 | Approved |
0.6064 | Remote Similarity | NPD4820 | Approved |
0.6 | Remote Similarity | NPD1695 | Approved |
0.6 | Remote Similarity | NPD6898 | Phase 1 |
0.5978 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.5957 | Remote Similarity | NPD6683 | Phase 2 |
0.5941 | Remote Similarity | NPD7838 | Discovery |
0.5932 | Remote Similarity | NPD8033 | Approved |
0.5918 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5888 | Remote Similarity | NPD5344 | Discontinued |
0.5888 | Remote Similarity | NPD4159 | Approved |
0.5876 | Remote Similarity | NPD5331 | Approved |
0.5876 | Remote Similarity | NPD5332 | Approved |
0.5876 | Remote Similarity | NPD5362 | Discontinued |
0.5851 | Remote Similarity | NPD4268 | Approved |
0.5851 | Remote Similarity | NPD4271 | Approved |
0.5812 | Remote Similarity | NPD7327 | Approved |
0.5812 | Remote Similarity | NPD7328 | Approved |
0.5789 | Remote Similarity | NPD6053 | Discontinued |
0.5784 | Remote Similarity | NPD46 | Approved |
0.5784 | Remote Similarity | NPD6698 | Approved |
0.5766 | Remote Similarity | NPD6412 | Phase 2 |
0.5766 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.5763 | Remote Similarity | NPD7516 | Approved |
0.5729 | Remote Similarity | NPD7525 | Registered |
0.5729 | Remote Similarity | NPD7509 | Discontinued |
0.5729 | Remote Similarity | NPD4748 | Discontinued |
0.5728 | Remote Similarity | NPD7637 | Suspended |
0.5727 | Remote Similarity | NPD4056 | Clinical (unspecified phase) |
0.5727 | Remote Similarity | NPD4057 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD8377 | Approved |
0.5714 | Remote Similarity | NPD8294 | Approved |
0.5699 | Remote Similarity | NPD6942 | Approved |
0.5699 | Remote Similarity | NPD7339 | Approved |
0.5684 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.5667 | Remote Similarity | NPD6923 | Approved |
0.5667 | Remote Similarity | NPD8379 | Approved |
0.5667 | Remote Similarity | NPD8378 | Approved |
0.5667 | Remote Similarity | NPD6922 | Approved |
0.5667 | Remote Similarity | NPD8335 | Approved |
0.5667 | Remote Similarity | NPD8380 | Approved |
0.5667 | Remote Similarity | NPD8296 | Approved |
0.5632 | Remote Similarity | NPD371 | Approved |
0.5631 | Remote Similarity | NPD3168 | Discontinued |
0.5619 | Remote Similarity | NPD5282 | Discontinued |
0.5612 | Remote Similarity | NPD6435 | Approved |
0.5604 | Remote Similarity | NPD7143 | Approved |
0.5604 | Remote Similarity | NPD7144 | Approved |
0.5603 | Remote Similarity | NPD8133 | Approved |
PubChem CID   | 44593488 |
ChEMBL   | CHEMBL465757 |
ZINC   |
Molecular Weight:   | 250.16 |
ALogP:   | 0.2307 |
MLogP:   | 2.78 |
XLogP:   | 0.567 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 52.99 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 2 |
# Rings:   | 4 |
# Heavy Atoms:   | 18 |