Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Activity | = | 2.5 | % | 15686910 | |
NPT2 | Others | Unspecified | IC50 | = | 10300 | nM | 15324894 | |
NPT2 | Others | Unspecified | IC50 | = | 110 | nM | 1593279 | |
NPT2 | Others | Unspecified | IC50 | = | 350 | nM | 1593279 | |
NPT2 | Others | Unspecified | Activity | = | 32.5 | % | 17480098 | |
NPT2 | Others | Unspecified | Activity | = | 1.5 | % | 17480098 | |
NPT165 | Cell Line | HeLa | Homo sapiens | Activity | = | 22.2 | % | 17480098 |
NPT165 | Cell Line | HeLa | Homo sapiens | Activity | = | 27.1 | % | 18278868 |
NPT165 | Cell Line | HeLa | Homo sapiens | Activity | = | 15.6 | % | 18278868 |
NPT165 | Cell Line | HeLa | Homo sapiens | Activity | = | 54.9 | % | 18278868 |
NPT165 | Cell Line | HeLa | Homo sapiens | Activity | = | 22.9 | % | 17958396 |
NPT165 | Cell Line | HeLa | Homo sapiens | Activity | = | 57.3 | % | 17958396 |
NPT2 | Others | Unspecified | Activity | = | 66 | % | 16420055 | |
NPT2 | Others | Unspecified | Activity | = | 26.7 | % | 16420055 | |
NPT2 | Others | Unspecified | Activity | = | 70.8 | % | 16420055 | |
NPT165 | Cell Line | HeLa | Homo sapiens | IC50 | = | 5300 | nM | 25467159 |
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 NPC471275 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 |
---|---|---|
1.0 | High Similarity | NPC471276 |
1.0 | High Similarity | NPC471280 |
1.0 | High Similarity | NPC125122 |
0.9783 | High Similarity | NPC471281 |
0.9783 | High Similarity | NPC199286 |
0.9783 | High Similarity | NPC477727 |
0.9574 | High Similarity | NPC89824 |
0.9574 | High Similarity | NPC170776 |
0.9574 | High Similarity | NPC329608 |
0.9574 | High Similarity | NPC256656 |
0.9574 | High Similarity | NPC197272 |
0.9574 | High Similarity | NPC224148 |
0.9574 | High Similarity | NPC477723 |
0.9574 | High Similarity | NPC76198 |
0.9574 | High Similarity | NPC55383 |
0.9574 | High Similarity | NPC9273 |
0.9574 | High Similarity | NPC471959 |
0.9574 | High Similarity | NPC294278 |
0.9574 | High Similarity | NPC165447 |
0.9574 | High Similarity | NPC475477 |
0.9565 | High Similarity | NPC248884 |
0.9565 | High Similarity | NPC31194 |
0.9565 | High Similarity | NPC85079 |
0.9556 | High Similarity | NPC35141 |
0.9556 | High Similarity | NPC124183 |
0.9362 | High Similarity | NPC473913 |
0.9362 | High Similarity | NPC474642 |
0.9362 | High Similarity | NPC72699 |
0.9362 | High Similarity | NPC249670 |
0.9167 | High Similarity | NPC151782 |
0.9149 | High Similarity | NPC153538 |
0.913 | High Similarity | NPC19834 |
0.913 | High Similarity | NPC55063 |
0.9111 | High Similarity | NPC101616 |
0.9 | High Similarity | NPC473532 |
0.9 | High Similarity | NPC48058 |
0.8913 | High Similarity | NPC269074 |
0.8824 | High Similarity | NPC473725 |
0.8824 | High Similarity | NPC473910 |
0.8824 | High Similarity | NPC475353 |
0.8824 | High Similarity | NPC471239 |
0.8824 | High Similarity | NPC473735 |
0.8824 | High Similarity | NPC473721 |
0.8824 | High Similarity | NPC474513 |
0.8824 | High Similarity | NPC477725 |
0.8824 | High Similarity | NPC470963 |
0.8824 | High Similarity | NPC477726 |
0.8824 | High Similarity | NPC473896 |
0.8824 | High Similarity | NPC146551 |
0.8776 | High Similarity | NPC93639 |
0.8667 | High Similarity | NPC149668 |
0.8654 | High Similarity | NPC470966 |
0.8654 | High Similarity | NPC470968 |
0.8654 | High Similarity | NPC475384 |
0.8654 | High Similarity | NPC161838 |
0.8654 | High Similarity | NPC470969 |
0.8654 | High Similarity | NPC471960 |
0.8654 | High Similarity | NPC470967 |
0.8654 | High Similarity | NPC311648 |
0.8654 | High Similarity | NPC473847 |
0.8654 | High Similarity | NPC477661 |
0.8654 | High Similarity | NPC470964 |
0.8627 | High Similarity | NPC256209 |
0.8627 | High Similarity | NPC49059 |
0.86 | High Similarity | NPC142092 |
0.8491 | Intermediate Similarity | NPC594 |
0.8491 | Intermediate Similarity | NPC48968 |
0.8491 | Intermediate Similarity | NPC470970 |
0.8462 | Intermediate Similarity | NPC152668 |
0.8462 | Intermediate Similarity | NPC474644 |
0.84 | Intermediate Similarity | NPC71053 |
0.84 | Intermediate Similarity | NPC129263 |
0.84 | Intermediate Similarity | NPC59408 |
0.8333 | Intermediate Similarity | NPC180575 |
0.8333 | Intermediate Similarity | NPC157096 |
0.8302 | Intermediate Similarity | NPC473865 |
0.8302 | Intermediate Similarity | NPC474643 |
0.8269 | Intermediate Similarity | NPC110732 |
0.8261 | Intermediate Similarity | NPC304151 |
0.8222 | Intermediate Similarity | NPC329762 |
0.8222 | Intermediate Similarity | NPC27444 |
0.8222 | Intermediate Similarity | NPC103236 |
0.82 | Intermediate Similarity | NPC291437 |
0.82 | Intermediate Similarity | NPC328784 |
0.8182 | Intermediate Similarity | NPC473652 |
0.8148 | Intermediate Similarity | NPC193975 |
0.8077 | Intermediate Similarity | NPC34577 |
0.8077 | Intermediate Similarity | NPC26102 |
0.8077 | Intermediate Similarity | NPC477724 |
0.8077 | Intermediate Similarity | NPC187361 |
0.8036 | Intermediate Similarity | NPC471278 |
0.8 | Intermediate Similarity | NPC302310 |
0.7917 | Intermediate Similarity | NPC108195 |
0.7895 | Intermediate Similarity | NPC168407 |
0.7895 | Intermediate Similarity | NPC475984 |
0.7818 | Intermediate Similarity | NPC212730 |
0.7818 | Intermediate Similarity | NPC265551 |
0.7759 | Intermediate Similarity | NPC470965 |
0.7736 | Intermediate Similarity | NPC61177 |
0.7692 | Intermediate Similarity | NPC474495 |
0.7692 | Intermediate Similarity | NPC473672 |
0.7609 | Intermediate Similarity | NPC15934 |
0.7586 | Intermediate Similarity | NPC271282 |
0.7586 | Intermediate Similarity | NPC325929 |
0.7586 | Intermediate Similarity | NPC66460 |
0.7556 | Intermediate Similarity | NPC216416 |
0.75 | Intermediate Similarity | NPC206906 |
0.75 | Intermediate Similarity | NPC473768 |
0.75 | Intermediate Similarity | NPC44542 |
0.7458 | Intermediate Similarity | NPC29697 |
0.74 | Intermediate Similarity | NPC276825 |
0.7333 | Intermediate Similarity | NPC213767 |
0.7308 | Intermediate Similarity | NPC475153 |
0.7258 | Intermediate Similarity | NPC473752 |
0.7193 | Intermediate Similarity | NPC471277 |
0.7193 | Intermediate Similarity | NPC472445 |
0.7193 | Intermediate Similarity | NPC471279 |
0.717 | Intermediate Similarity | NPC475071 |
0.7091 | Intermediate Similarity | NPC474496 |
0.7091 | Intermediate Similarity | NPC284224 |
0.7049 | Intermediate Similarity | NPC470320 |
0.7049 | Intermediate Similarity | NPC226592 |
0.7037 | Intermediate Similarity | NPC29234 |
0.7 | Intermediate Similarity | NPC477829 |
0.7 | Intermediate Similarity | NPC116934 |
0.6949 | Remote Similarity | NPC222852 |
0.6939 | Remote Similarity | NPC269823 |
0.6909 | Remote Similarity | NPC473705 |
0.6909 | Remote Similarity | NPC35756 |
0.6889 | Remote Similarity | NPC62779 |
0.6875 | Remote Similarity | NPC255042 |
0.6875 | Remote Similarity | NPC103213 |
0.6875 | Remote Similarity | NPC182840 |
0.6875 | Remote Similarity | NPC306850 |
0.6875 | Remote Similarity | NPC29091 |
0.6863 | Remote Similarity | NPC138935 |
0.6852 | Remote Similarity | NPC182102 |
0.6852 | Remote Similarity | NPC26960 |
0.6852 | Remote Similarity | NPC474460 |
0.6842 | Remote Similarity | NPC317899 |
0.68 | Remote Similarity | NPC249801 |
0.68 | Remote Similarity | NPC213538 |
0.68 | Remote Similarity | NPC46248 |
0.68 | Remote Similarity | NPC31121 |
0.68 | Remote Similarity | NPC256766 |
0.6792 | Remote Similarity | NPC471958 |
0.6786 | Remote Similarity | NPC475723 |
0.6786 | Remote Similarity | NPC217188 |
0.678 | Remote Similarity | NPC181872 |
0.6739 | Remote Similarity | NPC58957 |
0.6731 | Remote Similarity | NPC140501 |
0.6731 | Remote Similarity | NPC474202 |
0.6731 | Remote Similarity | NPC76976 |
0.6731 | Remote Similarity | NPC160628 |
0.6731 | Remote Similarity | NPC474362 |
0.6667 | Remote Similarity | NPC252978 |
0.6667 | Remote Similarity | NPC122239 |
0.6667 | Remote Similarity | NPC474267 |
0.6667 | Remote Similarity | NPC269615 |
0.6667 | Remote Similarity | NPC473866 |
0.6667 | Remote Similarity | NPC267110 |
0.6613 | Remote Similarity | NPC55068 |
0.661 | Remote Similarity | NPC474577 |
0.661 | Remote Similarity | NPC121034 |
0.6557 | Remote Similarity | NPC327112 |
0.6552 | Remote Similarity | NPC329686 |
0.6552 | Remote Similarity | NPC227135 |
0.6545 | Remote Similarity | NPC473487 |
0.6545 | Remote Similarity | NPC20934 |
0.6545 | Remote Similarity | NPC288381 |
0.6538 | Remote Similarity | NPC267514 |
0.6538 | Remote Similarity | NPC474413 |
0.6538 | Remote Similarity | NPC145755 |
0.6538 | Remote Similarity | NPC473539 |
0.6522 | Remote Similarity | NPC250734 |
0.65 | Remote Similarity | NPC226848 |
0.65 | Remote Similarity | NPC469373 |
0.6444 | Remote Similarity | NPC196831 |
0.6441 | Remote Similarity | NPC472808 |
0.6441 | Remote Similarity | NPC324224 |
0.6441 | Remote Similarity | NPC249645 |
0.6441 | Remote Similarity | NPC55412 |
0.6429 | Remote Similarity | NPC200772 |
0.6429 | Remote Similarity | NPC244038 |
0.6406 | Remote Similarity | NPC136164 |
0.6406 | Remote Similarity | NPC308844 |
0.6406 | Remote Similarity | NPC245947 |
0.6406 | Remote Similarity | NPC255863 |
0.6393 | Remote Similarity | NPC329424 |
0.6393 | Remote Similarity | NPC475931 |
0.6383 | Remote Similarity | NPC182392 |
0.6379 | Remote Similarity | NPC189677 |
0.6379 | Remote Similarity | NPC300121 |
0.6327 | Remote Similarity | NPC34873 |
0.6327 | Remote Similarity | NPC40434 |
0.6316 | Remote Similarity | NPC106531 |
0.629 | Remote Similarity | NPC471081 |
0.629 | Remote Similarity | NPC130807 |
0.6271 | Remote Similarity | NPC232247 |
0.6271 | Remote Similarity | NPC251666 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC471275 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 |
---|---|---|---|
0.6731 | Remote Similarity | NPD4265 | Approved |
0.6613 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6557 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.6441 | Remote Similarity | NPD4219 | Approved |
0.6 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.5968 | Remote Similarity | NPD585 | Clinical (unspecified phase) |
0.5942 | Remote Similarity | NPD3212 | Clinical (unspecified phase) |
0.5938 | Remote Similarity | NPD368 | Approved |
0.5789 | Remote Similarity | NPD4220 | Pre-registration |
0.5758 | Remote Similarity | NPD3197 | Phase 1 |
0.5738 | Remote Similarity | NPD342 | Phase 1 |
0.5735 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.5641 | Remote Similarity | NPD5332 | Approved |
0.5641 | Remote Similarity | NPD5331 | Approved |
0.5616 | Remote Similarity | NPD8264 | Approved |
PubChem CID   | 71747206 |
ChEMBL   | CHEMBL2408390 |
ZINC   |
Molecular Weight:   | 302.22 |
ALogP:   | -0.3488 |
MLogP:   | 3.44 |
XLogP:   | 5.548 |
# Rotatable Bonds:   | 15 |
Polar Surface Area:   | 40.46 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 2 |
# Rings:   | 0 |
# Heavy Atoms:   | 22 |