Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT15 | Cell Line | Jurkat | Homo sapiens | IC50 | = | 20 | ug/ml | 25894905 |
NPT1198 | Organism | Magnaporthe grisea | Magnaporthe grisea | IC50 | = | 10 | ug/ml | 25871540 |
NPT116 | Cell Line | HL-60 | Homo sapiens | IC50 | = | 5 | ug/ml | 25871540 |
NPT165 | Cell Line | HeLa | Homo sapiens | IC50 | = | 75 | ug/ml | 15974616 |
NPT2 | Others | Unspecified | IC50 | = | 75 | ug/ml | 19215141 |
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 NPC227135 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 |
---|---|---|
0.8889 | High Similarity | NPC281590 |
0.8571 | High Similarity | NPC52012 |
0.8448 | Intermediate Similarity | NPC469694 |
0.8361 | Intermediate Similarity | NPC267027 |
0.8276 | Intermediate Similarity | NPC475931 |
0.8276 | Intermediate Similarity | NPC278202 |
0.8103 | Intermediate Similarity | NPC181872 |
0.8103 | Intermediate Similarity | NPC155025 |
0.8033 | Intermediate Similarity | NPC300593 |
0.8 | Intermediate Similarity | NPC207007 |
0.8 | Intermediate Similarity | NPC64971 |
0.8 | Intermediate Similarity | NPC321867 |
0.8 | Intermediate Similarity | NPC35756 |
0.8 | Intermediate Similarity | NPC68679 |
0.7966 | Intermediate Similarity | NPC122239 |
0.7963 | Intermediate Similarity | NPC474460 |
0.7937 | Intermediate Similarity | NPC82337 |
0.7903 | Intermediate Similarity | NPC308844 |
0.7857 | Intermediate Similarity | NPC474496 |
0.7833 | Intermediate Similarity | NPC240506 |
0.7833 | Intermediate Similarity | NPC99487 |
0.7833 | Intermediate Similarity | NPC66020 |
0.7818 | Intermediate Similarity | NPC473672 |
0.7818 | Intermediate Similarity | NPC474495 |
0.7797 | Intermediate Similarity | NPC226848 |
0.7778 | Intermediate Similarity | NPC326310 |
0.7778 | Intermediate Similarity | NPC311736 |
0.7759 | Intermediate Similarity | NPC48891 |
0.7705 | Intermediate Similarity | NPC225342 |
0.7692 | Intermediate Similarity | NPC472947 |
0.7656 | Intermediate Similarity | NPC73603 |
0.7656 | Intermediate Similarity | NPC163290 |
0.7647 | Intermediate Similarity | NPC249801 |
0.7647 | Intermediate Similarity | NPC209279 |
0.7647 | Intermediate Similarity | NPC51758 |
0.7647 | Intermediate Similarity | NPC68889 |
0.7647 | Intermediate Similarity | NPC180871 |
0.7647 | Intermediate Similarity | NPC46248 |
0.7647 | Intermediate Similarity | NPC67761 |
0.7647 | Intermediate Similarity | NPC194586 |
0.7647 | Intermediate Similarity | NPC108494 |
0.7647 | Intermediate Similarity | NPC88079 |
0.7619 | Intermediate Similarity | NPC471200 |
0.7586 | Intermediate Similarity | NPC251666 |
0.7586 | Intermediate Similarity | NPC329686 |
0.7586 | Intermediate Similarity | NPC232247 |
0.7581 | Intermediate Similarity | NPC473508 |
0.7547 | Intermediate Similarity | NPC165651 |
0.7547 | Intermediate Similarity | NPC24824 |
0.7547 | Intermediate Similarity | NPC210560 |
0.7544 | Intermediate Similarity | NPC217188 |
0.7541 | Intermediate Similarity | NPC258788 |
0.75 | Intermediate Similarity | NPC137163 |
0.75 | Intermediate Similarity | NPC93639 |
0.7424 | Intermediate Similarity | NPC473893 |
0.7419 | Intermediate Similarity | NPC475251 |
0.7414 | Intermediate Similarity | NPC110732 |
0.7414 | Intermediate Similarity | NPC256209 |
0.7414 | Intermediate Similarity | NPC49059 |
0.7385 | Intermediate Similarity | NPC259299 |
0.7385 | Intermediate Similarity | NPC473357 |
0.7385 | Intermediate Similarity | NPC193029 |
0.7368 | Intermediate Similarity | NPC294358 |
0.7368 | Intermediate Similarity | NPC68014 |
0.7368 | Intermediate Similarity | NPC40417 |
0.7344 | Intermediate Similarity | NPC473722 |
0.7333 | Intermediate Similarity | NPC121034 |
0.7321 | Intermediate Similarity | NPC329773 |
0.7313 | Intermediate Similarity | NPC129630 |
0.7302 | Intermediate Similarity | NPC474155 |
0.7302 | Intermediate Similarity | NPC473759 |
0.7288 | Intermediate Similarity | NPC317899 |
0.7288 | Intermediate Similarity | NPC148216 |
0.7288 | Intermediate Similarity | NPC130209 |
0.7288 | Intermediate Similarity | NPC148163 |
0.7273 | Intermediate Similarity | NPC310210 |
0.7273 | Intermediate Similarity | NPC305698 |
0.7273 | Intermediate Similarity | NPC224532 |
0.7246 | Intermediate Similarity | NPC190859 |
0.7231 | Intermediate Similarity | NPC250977 |
0.7222 | Intermediate Similarity | NPC140501 |
0.7213 | Intermediate Similarity | NPC152438 |
0.7213 | Intermediate Similarity | NPC41180 |
0.7206 | Intermediate Similarity | NPC471268 |
0.7206 | Intermediate Similarity | NPC471271 |
0.7193 | Intermediate Similarity | NPC151782 |
0.7193 | Intermediate Similarity | NPC26906 |
0.7193 | Intermediate Similarity | NPC59408 |
0.7193 | Intermediate Similarity | NPC71053 |
0.7193 | Intermediate Similarity | NPC214584 |
0.7188 | Intermediate Similarity | NPC309300 |
0.7188 | Intermediate Similarity | NPC110241 |
0.717 | Intermediate Similarity | NPC15162 |
0.717 | Intermediate Similarity | NPC252978 |
0.7167 | Intermediate Similarity | NPC24443 |
0.7164 | Intermediate Similarity | NPC471560 |
0.7164 | Intermediate Similarity | NPC16964 |
0.7164 | Intermediate Similarity | NPC329989 |
0.7164 | Intermediate Similarity | NPC239373 |
0.7143 | Intermediate Similarity | NPC153538 |
0.7121 | Intermediate Similarity | NPC477791 |
0.7121 | Intermediate Similarity | NPC136813 |
0.7115 | Intermediate Similarity | NPC188596 |
0.7097 | Intermediate Similarity | NPC473866 |
0.7083 | Intermediate Similarity | NPC475980 |
0.7077 | Intermediate Similarity | NPC19569 |
0.7077 | Intermediate Similarity | NPC250836 |
0.7077 | Intermediate Similarity | NPC287339 |
0.7069 | Intermediate Similarity | NPC179169 |
0.7069 | Intermediate Similarity | NPC157781 |
0.7069 | Intermediate Similarity | NPC306195 |
0.7069 | Intermediate Similarity | NPC181255 |
0.7069 | Intermediate Similarity | NPC35519 |
0.7042 | Intermediate Similarity | NPC170148 |
0.7042 | Intermediate Similarity | NPC126969 |
0.7042 | Intermediate Similarity | NPC236228 |
0.7042 | Intermediate Similarity | NPC256720 |
0.7018 | Intermediate Similarity | NPC288381 |
0.7018 | Intermediate Similarity | NPC20934 |
0.7018 | Intermediate Similarity | NPC182102 |
0.7018 | Intermediate Similarity | NPC26960 |
0.7018 | Intermediate Similarity | NPC72699 |
0.7015 | Intermediate Similarity | NPC117804 |
0.7015 | Intermediate Similarity | NPC471238 |
0.7015 | Intermediate Similarity | NPC272961 |
0.7015 | Intermediate Similarity | NPC167527 |
0.7 | Intermediate Similarity | NPC475353 |
0.7 | Intermediate Similarity | NPC477726 |
0.7 | Intermediate Similarity | NPC474644 |
0.7 | Intermediate Similarity | NPC227814 |
0.7 | Intermediate Similarity | NPC471525 |
0.7 | Intermediate Similarity | NPC477725 |
0.7 | Intermediate Similarity | NPC144995 |
0.7 | Intermediate Similarity | NPC473896 |
0.7 | Intermediate Similarity | NPC473735 |
0.7 | Intermediate Similarity | NPC473721 |
0.7 | Intermediate Similarity | NPC473725 |
0.7 | Intermediate Similarity | NPC473910 |
0.6984 | Remote Similarity | NPC471081 |
0.697 | Remote Similarity | NPC202017 |
0.6957 | Remote Similarity | NPC471272 |
0.6957 | Remote Similarity | NPC41886 |
0.6957 | Remote Similarity | NPC242992 |
0.6957 | Remote Similarity | NPC23954 |
0.6949 | Remote Similarity | NPC165755 |
0.6944 | Remote Similarity | NPC40049 |
0.6944 | Remote Similarity | NPC476703 |
0.6935 | Remote Similarity | NPC475830 |
0.6923 | Remote Similarity | NPC56917 |
0.6923 | Remote Similarity | NPC96793 |
0.6923 | Remote Similarity | NPC323424 |
0.6912 | Remote Similarity | NPC217570 |
0.6912 | Remote Similarity | NPC90115 |
0.6912 | Remote Similarity | NPC304690 |
0.6912 | Remote Similarity | NPC74722 |
0.6909 | Remote Similarity | NPC87439 |
0.6909 | Remote Similarity | NPC76976 |
0.6897 | Remote Similarity | NPC129263 |
0.6897 | Remote Similarity | NPC200772 |
0.6897 | Remote Similarity | NPC244038 |
0.6897 | Remote Similarity | NPC29234 |
0.6885 | Remote Similarity | NPC477661 |
0.6885 | Remote Similarity | NPC471960 |
0.6885 | Remote Similarity | NPC470969 |
0.6885 | Remote Similarity | NPC475384 |
0.6885 | Remote Similarity | NPC470968 |
0.6885 | Remote Similarity | NPC470967 |
0.6885 | Remote Similarity | NPC473847 |
0.6885 | Remote Similarity | NPC470966 |
0.6885 | Remote Similarity | NPC474643 |
0.6885 | Remote Similarity | NPC161838 |
0.6885 | Remote Similarity | NPC473865 |
0.6875 | Remote Similarity | NPC274704 |
0.6875 | Remote Similarity | NPC55376 |
0.6866 | Remote Similarity | NPC114651 |
0.6866 | Remote Similarity | NPC472255 |
0.6866 | Remote Similarity | NPC472253 |
0.6863 | Remote Similarity | NPC40434 |
0.6863 | Remote Similarity | NPC34873 |
0.6857 | Remote Similarity | NPC329763 |
0.6857 | Remote Similarity | NPC220939 |
0.6857 | Remote Similarity | NPC265485 |
0.6857 | Remote Similarity | NPC130665 |
0.6857 | Remote Similarity | NPC476709 |
0.6852 | Remote Similarity | NPC116934 |
0.6849 | Remote Similarity | NPC167891 |
0.6849 | Remote Similarity | NPC83351 |
0.6842 | Remote Similarity | NPC248884 |
0.6842 | Remote Similarity | NPC31194 |
0.6842 | Remote Similarity | NPC302310 |
0.6842 | Remote Similarity | NPC85079 |
0.6833 | Remote Similarity | NPC473532 |
0.6825 | Remote Similarity | NPC83838 |
0.6825 | Remote Similarity | NPC143810 |
0.6818 | Remote Similarity | NPC61503 |
0.6812 | Remote Similarity | NPC473361 |
0.6812 | Remote Similarity | NPC189745 |
0.6812 | Remote Similarity | NPC4299 |
0.6812 | Remote Similarity | NPC329904 |
0.6812 | Remote Similarity | NPC471781 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC227135 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 |
---|---|---|---|
0.8 | Intermediate Similarity | NPD368 | Approved |
0.7288 | Intermediate Similarity | NPD342 | Phase 1 |
0.7222 | Intermediate Similarity | NPD4265 | Approved |
0.6857 | Remote Similarity | NPD4732 | Discontinued |
0.6719 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD8264 | Approved |
0.6622 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.6613 | Remote Similarity | NPD4219 | Approved |
0.6575 | Remote Similarity | NPD6933 | Approved |
0.6447 | Remote Similarity | NPD7514 | Phase 3 |
0.6447 | Remote Similarity | NPD7332 | Phase 2 |
0.6418 | Remote Similarity | NPD3197 | Phase 1 |
0.6406 | Remote Similarity | NPD585 | Clinical (unspecified phase) |
0.64 | Remote Similarity | NPD7145 | Approved |
0.6338 | Remote Similarity | NPD7143 | Approved |
0.6338 | Remote Similarity | NPD7144 | Approved |
0.6324 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.6301 | Remote Similarity | NPD6924 | Approved |
0.6301 | Remote Similarity | NPD6926 | Approved |
0.6267 | Remote Similarity | NPD5776 | Phase 2 |
0.6267 | Remote Similarity | NPD6925 | Approved |
0.6267 | Remote Similarity | NPD6932 | Approved |
0.625 | Remote Similarity | NPD7152 | Approved |
0.625 | Remote Similarity | NPD7150 | Approved |
0.625 | Remote Similarity | NPD7151 | Approved |
0.6234 | Remote Similarity | NPD4821 | Approved |
0.6234 | Remote Similarity | NPD6931 | Approved |
0.6234 | Remote Similarity | NPD4822 | Approved |
0.6234 | Remote Similarity | NPD6930 | Phase 2 |
0.6234 | Remote Similarity | NPD4819 | Approved |
0.6234 | Remote Similarity | NPD4820 | Approved |
0.6197 | Remote Similarity | NPD6923 | Approved |
0.6197 | Remote Similarity | NPD6922 | Approved |
0.6184 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6154 | Remote Similarity | NPD6902 | Approved |
0.6154 | Remote Similarity | NPD6898 | Phase 1 |
0.6104 | Remote Similarity | NPD6929 | Approved |
0.6098 | Remote Similarity | NPD7524 | Approved |
0.6029 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD5332 | Approved |
0.6 | Remote Similarity | NPD6695 | Phase 3 |
0.6 | Remote Similarity | NPD7154 | Phase 3 |
0.6 | Remote Similarity | NPD5362 | Discontinued |
0.6 | Remote Similarity | NPD7331 | Phase 2 |
0.6 | Remote Similarity | NPD5331 | Approved |
0.5974 | Remote Similarity | NPD4268 | Approved |
0.5974 | Remote Similarity | NPD4271 | Approved |
0.5949 | Remote Similarity | NPD4790 | Discontinued |
0.5926 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.5915 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.5909 | Remote Similarity | NPD6109 | Phase 1 |
0.5897 | Remote Similarity | NPD6683 | Phase 2 |
0.5875 | Remote Similarity | NPD4269 | Approved |
0.5875 | Remote Similarity | NPD4270 | Approved |
0.5854 | Remote Similarity | NPD6893 | Approved |
0.5823 | Remote Similarity | NPD4252 | Approved |
0.5823 | Remote Similarity | NPD7509 | Discontinued |
0.5823 | Remote Similarity | NPD7525 | Registered |
0.5823 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5814 | Remote Similarity | NPD7983 | Approved |
0.5802 | Remote Similarity | NPD6110 | Phase 1 |
0.5789 | Remote Similarity | NPD6942 | Approved |
0.5789 | Remote Similarity | NPD7339 | Approved |
0.575 | Remote Similarity | NPD5369 | Approved |
0.5738 | Remote Similarity | NPD3173 | Approved |
0.5714 | Remote Similarity | NPD7750 | Discontinued |
0.5714 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.5698 | Remote Similarity | NPD7838 | Discovery |
0.5696 | Remote Similarity | NPD7645 | Phase 2 |
0.5663 | Remote Similarity | NPD5363 | Approved |
0.5652 | Remote Similarity | NPD4194 | Approved |
0.5652 | Remote Similarity | NPD4193 | Approved |
0.5652 | Remote Similarity | NPD4191 | Approved |
0.5652 | Remote Similarity | NPD4192 | Approved |
0.5625 | Remote Similarity | NPD3172 | Approved |
0.5625 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.5625 | Remote Similarity | NPD5368 | Approved |
PubChem CID   | 10355067 |
ChEMBL   | CHEMBL487791 |
ZINC   |
Molecular Weight:   | 256.20 |
ALogP:   | 1.2247 |
MLogP:   | 2.78 |
XLogP:   | 1.941 |
# Rotatable Bonds:   | 15 |
Polar Surface Area:   | 60.69 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 3 |
# Rings:   | 0 |
# Heavy Atoms:   | 18 |