Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT20 | Organism | Candida albicans | Candida albicans | MIC | = | 0.25 | ug/ml | 19254038 |
NPT554 | Organism | Candida glabrata | Candida glabrata | MIC | = | 0.125 | ug/ml | 19254038 |
NPT85 | Organism | Filobasidiella neoformans | Cryptococcus neoformans | MIC | = | 0.5 | ug/ml | 19254038 |
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 NPC477219 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 |
---|---|---|
0.995 | High Similarity | NPC37924 |
0.99 | High Similarity | NPC325683 |
0.9802 | High Similarity | NPC476828 |
0.9755 | High Similarity | NPC177432 |
0.9755 | High Similarity | NPC299035 |
0.9707 | High Similarity | NPC322800 |
0.9707 | High Similarity | NPC477218 |
0.9707 | High Similarity | NPC168135 |
0.9653 | High Similarity | NPC476826 |
0.9653 | High Similarity | NPC476827 |
0.9653 | High Similarity | NPC476831 |
0.9606 | High Similarity | NPC476830 |
0.9048 | High Similarity | NPC476832 |
0.8164 | Intermediate Similarity | NPC476829 |
0.744 | Intermediate Similarity | NPC314523 |
0.744 | Intermediate Similarity | NPC58001 |
0.7327 | Intermediate Similarity | NPC224395 |
0.7327 | Intermediate Similarity | NPC208297 |
0.7291 | Intermediate Similarity | NPC30527 |
0.7207 | Intermediate Similarity | NPC258022 |
0.7155 | Intermediate Similarity | NPC477588 |
0.7155 | Intermediate Similarity | NPC477585 |
0.7155 | Intermediate Similarity | NPC477586 |
0.7155 | Intermediate Similarity | NPC477590 |
0.7123 | Intermediate Similarity | NPC107458 |
0.7123 | Intermediate Similarity | NPC295653 |
0.7097 | Intermediate Similarity | NPC58112 |
0.7097 | Intermediate Similarity | NPC88938 |
0.7097 | Intermediate Similarity | NPC306300 |
0.7071 | Intermediate Similarity | NPC477587 |
0.7071 | Intermediate Similarity | NPC477589 |
0.6982 | Remote Similarity | NPC48323 |
0.6982 | Remote Similarity | NPC289029 |
0.6895 | Remote Similarity | NPC199461 |
0.6895 | Remote Similarity | NPC46313 |
0.6895 | Remote Similarity | NPC103452 |
0.6824 | Remote Similarity | NPC49195 |
0.6742 | Remote Similarity | NPC315411 |
0.6681 | Remote Similarity | NPC309919 |
0.6667 | Remote Similarity | NPC472436 |
0.6652 | Remote Similarity | NPC315872 |
0.6568 | Remote Similarity | NPC315061 |
0.6549 | Remote Similarity | NPC472435 |
0.653 | Remote Similarity | NPC314222 |
0.653 | Remote Similarity | NPC196449 |
0.6476 | Remote Similarity | NPC211555 |
0.6457 | Remote Similarity | NPC165964 |
0.6429 | Remote Similarity | NPC186452 |
0.6423 | Remote Similarity | NPC102593 |
0.6423 | Remote Similarity | NPC196718 |
0.6308 | Remote Similarity | NPC12660 |
0.6308 | Remote Similarity | NPC258048 |
0.6299 | Remote Similarity | NPC472434 |
0.6279 | Remote Similarity | NPC54983 |
0.6275 | Remote Similarity | NPC72715 |
0.627 | Remote Similarity | NPC314633 |
0.625 | Remote Similarity | NPC161801 |
0.6245 | Remote Similarity | NPC148889 |
0.6206 | Remote Similarity | NPC207620 |
0.6203 | Remote Similarity | NPC471979 |
0.6184 | Remote Similarity | NPC169716 |
0.6175 | Remote Similarity | NPC182222 |
0.6173 | Remote Similarity | NPC315804 |
0.6173 | Remote Similarity | NPC313804 |
0.6133 | Remote Similarity | NPC316224 |
0.609 | Remote Similarity | NPC471978 |
0.6085 | Remote Similarity | NPC58209 |
0.6077 | Remote Similarity | NPC10904 |
0.6075 | Remote Similarity | NPC473833 |
0.6074 | Remote Similarity | NPC477979 |
0.6071 | Remote Similarity | NPC141053 |
0.6067 | Remote Similarity | NPC152620 |
0.6064 | Remote Similarity | NPC140296 |
0.6064 | Remote Similarity | NPC186351 |
0.605 | Remote Similarity | NPC316403 |
0.6048 | Remote Similarity | NPC97746 |
0.6031 | Remote Similarity | NPC124300 |
0.603 | Remote Similarity | NPC328928 |
0.6026 | Remote Similarity | NPC220408 |
0.6023 | Remote Similarity | NPC53534 |
0.6023 | Remote Similarity | NPC310618 |
0.6008 | Remote Similarity | NPC471015 |
0.6008 | Remote Similarity | NPC291609 |
0.6008 | Remote Similarity | NPC205372 |
0.6 | Remote Similarity | NPC131885 |
0.5985 | Remote Similarity | NPC475301 |
0.5985 | Remote Similarity | NPC326930 |
0.5976 | Remote Similarity | NPC298436 |
0.5975 | Remote Similarity | NPC269367 |
0.5963 | Remote Similarity | NPC470042 |
0.5962 | Remote Similarity | NPC13603 |
0.5954 | Remote Similarity | NPC26543 |
0.5945 | Remote Similarity | NPC220852 |
0.5925 | Remote Similarity | NPC85879 |
0.5925 | Remote Similarity | NPC53255 |
0.5923 | Remote Similarity | NPC148896 |
0.5923 | Remote Similarity | NPC180668 |
0.5923 | Remote Similarity | NPC471013 |
0.5913 | Remote Similarity | NPC194740 |
0.5911 | Remote Similarity | NPC230683 |
0.5911 | Remote Similarity | NPC209981 |
0.5907 | Remote Similarity | NPC166712 |
0.5885 | Remote Similarity | NPC146418 |
0.5885 | Remote Similarity | NPC75179 |
0.5885 | Remote Similarity | NPC208364 |
0.5885 | Remote Similarity | NPC160100 |
0.5885 | Remote Similarity | NPC188400 |
0.5878 | Remote Similarity | NPC16066 |
0.5875 | Remote Similarity | NPC240384 |
0.5875 | Remote Similarity | NPC285343 |
0.5873 | Remote Similarity | NPC244536 |
0.5871 | Remote Similarity | NPC67401 |
0.587 | Remote Similarity | NPC314270 |
0.5859 | Remote Similarity | NPC34770 |
0.5856 | Remote Similarity | NPC63971 |
0.5856 | Remote Similarity | NPC91868 |
0.5853 | Remote Similarity | NPC474183 |
0.5836 | Remote Similarity | NPC185197 |
0.5833 | Remote Similarity | NPC203373 |
0.583 | Remote Similarity | NPC312645 |
0.5826 | Remote Similarity | NPC287208 |
0.5823 | Remote Similarity | NPC323969 |
0.5817 | Remote Similarity | NPC324619 |
0.5817 | Remote Similarity | NPC475315 |
0.5814 | Remote Similarity | NPC184680 |
0.5811 | Remote Similarity | NPC313587 |
0.5811 | Remote Similarity | NPC316110 |
0.5811 | Remote Similarity | NPC256912 |
0.5811 | Remote Similarity | NPC315893 |
0.5809 | Remote Similarity | NPC472286 |
0.5809 | Remote Similarity | NPC472287 |
0.5804 | Remote Similarity | NPC260434 |
0.5797 | Remote Similarity | NPC314254 |
0.5797 | Remote Similarity | NPC313966 |
0.5795 | Remote Similarity | NPC173250 |
0.5794 | Remote Similarity | NPC212766 |
0.5794 | Remote Similarity | NPC289423 |
0.5792 | Remote Similarity | NPC470785 |
0.5792 | Remote Similarity | NPC470784 |
0.5792 | Remote Similarity | NPC317572 |
0.5788 | Remote Similarity | NPC227824 |
0.5784 | Remote Similarity | NPC120513 |
0.5779 | Remote Similarity | NPC314834 |
0.5779 | Remote Similarity | NPC475533 |
0.5777 | Remote Similarity | NPC478141 |
0.5775 | Remote Similarity | NPC57453 |
0.5769 | Remote Similarity | NPC168922 |
0.5768 | Remote Similarity | NPC472259 |
0.5768 | Remote Similarity | NPC329982 |
0.5762 | Remote Similarity | NPC476514 |
0.5759 | Remote Similarity | NPC284888 |
0.5758 | Remote Similarity | NPC1608 |
0.5756 | Remote Similarity | NPC282346 |
0.5756 | Remote Similarity | NPC187558 |
0.5756 | Remote Similarity | NPC18487 |
0.5752 | Remote Similarity | NPC473800 |
0.5752 | Remote Similarity | NPC181081 |
0.5752 | Remote Similarity | NPC475455 |
0.5749 | Remote Similarity | NPC153452 |
0.5747 | Remote Similarity | NPC99891 |
0.5744 | Remote Similarity | NPC313345 |
0.5744 | Remote Similarity | NPC313796 |
0.5744 | Remote Similarity | NPC315638 |
0.5744 | Remote Similarity | NPC314855 |
0.5743 | Remote Similarity | NPC281049 |
0.5742 | Remote Similarity | NPC14288 |
0.5742 | Remote Similarity | NPC217176 |
0.574 | Remote Similarity | NPC34319 |
0.5731 | Remote Similarity | NPC473449 |
0.5731 | Remote Similarity | NPC101350 |
0.5726 | Remote Similarity | NPC85702 |
0.5725 | Remote Similarity | NPC101312 |
0.5725 | Remote Similarity | NPC473639 |
0.572 | Remote Similarity | NPC471004 |
0.572 | Remote Similarity | NPC321592 |
0.572 | Remote Similarity | NPC54803 |
0.572 | Remote Similarity | NPC314297 |
0.572 | Remote Similarity | NPC315545 |
0.5714 | Remote Similarity | NPC123839 |
0.5714 | Remote Similarity | NPC102008 |
0.5709 | Remote Similarity | NPC89508 |
0.5709 | Remote Similarity | NPC319232 |
0.5709 | Remote Similarity | NPC24370 |
0.5703 | Remote Similarity | NPC322135 |
0.5703 | Remote Similarity | NPC223409 |
0.5699 | Remote Similarity | NPC215837 |
0.5698 | Remote Similarity | NPC329631 |
0.5697 | Remote Similarity | NPC128115 |
0.5697 | Remote Similarity | NPC54066 |
0.5693 | Remote Similarity | NPC100734 |
0.5693 | Remote Similarity | NPC315634 |
0.5693 | Remote Similarity | NPC88923 |
0.5692 | Remote Similarity | NPC235685 |
0.5692 | Remote Similarity | NPC28945 |
0.5692 | Remote Similarity | NPC15801 |
0.5683 | Remote Similarity | NPC129897 |
0.568 | Remote Similarity | NPC303658 |
0.5678 | Remote Similarity | NPC192306 |
0.5676 | Remote Similarity | NPC475619 |
0.5675 | Remote Similarity | NPC90019 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC477219 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 |
---|---|---|---|
0.7091 | Intermediate Similarity | NPD7896 | Approved |
0.6652 | Remote Similarity | NPD6444 | Clinical (unspecified phase) |
0.6533 | Remote Similarity | NPD6347 | Phase 2 |
0.6513 | Remote Similarity | NPD6974 | Phase 3 |
0.6478 | Remote Similarity | NPD7853 | Phase 2 |
0.6449 | Remote Similarity | NPD7284 | Clinical (unspecified phase) |
0.6432 | Remote Similarity | NPD7490 | Discontinued |
0.6381 | Remote Similarity | NPD8370 | Discontinued |
0.6356 | Remote Similarity | NPD7031 | Phase 1 |
0.6337 | Remote Similarity | NPD7547 | Clinical (unspecified phase) |
0.6318 | Remote Similarity | NPD2433 | Clinical (unspecified phase) |
0.6281 | Remote Similarity | NPD7180 | Phase 3 |
0.6223 | Remote Similarity | NPD2779 | Approved |
0.6208 | Remote Similarity | NPD4667 | Clinical (unspecified phase) |
0.6206 | Remote Similarity | NPD7690 | Clinical (unspecified phase) |
0.6179 | Remote Similarity | NPD6247 | Clinical (unspecified phase) |
0.6145 | Remote Similarity | NPD4898 | Clinical (unspecified phase) |
0.6126 | Remote Similarity | NPD4368 | Phase 2 |
0.6111 | Remote Similarity | NPD5922 | Phase 3 |
0.6102 | Remote Similarity | NPD4394 | Clinical (unspecified phase) |
0.6098 | Remote Similarity | NPD8356 | Approved |
0.6094 | Remote Similarity | NPD8117 | Approved |
0.6094 | Remote Similarity | NPD2778 | Approved |
0.6094 | Remote Similarity | NPD8116 | Phase 3 |
0.6089 | Remote Similarity | NPD3263 | Phase 3 |
0.608 | Remote Similarity | NPD5924 | Discontinued |
0.6064 | Remote Similarity | NPD8430 | Approved |
0.6047 | Remote Similarity | NPD2951 | Discontinued |
0.6042 | Remote Similarity | NPD3392 | Approved |
0.6038 | Remote Similarity | NPD8324 | Phase 2 |
0.6033 | Remote Similarity | NPD3945 | Discontinued |
0.6031 | Remote Similarity | NPD7022 | Phase 2 |
0.6025 | Remote Similarity | NPD5443 | Clinical (unspecified phase) |
0.6024 | Remote Similarity | NPD5640 | Discontinued |
0.6023 | Remote Similarity | NPD8255 | Phase 2 |
0.6017 | Remote Similarity | NPD6567 | Clinical (unspecified phase) |
0.6016 | Remote Similarity | NPD5908 | Clinical (unspecified phase) |
0.6015 | Remote Similarity | NPD6525 | Clinical (unspecified phase) |
0.6008 | Remote Similarity | NPD5532 | Phase 2 |
0.6008 | Remote Similarity | NPD6169 | Phase 1 |
0.6 | Remote Similarity | NPD4958 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD7268 | Clinical (unspecified phase) |
0.5992 | Remote Similarity | NPD5866 | Approved |
0.5977 | Remote Similarity | NPD3801 | Clinical (unspecified phase) |
0.5973 | Remote Similarity | NPD8279 | Clinical (unspecified phase) |
0.5961 | Remote Similarity | NPD3006 | Discontinued |
0.5957 | Remote Similarity | NPD6857 | Phase 3 |
0.5954 | Remote Similarity | NPD5482 | Discontinued |
0.5953 | Remote Similarity | NPD2921 | Clinical (unspecified phase) |
0.5951 | Remote Similarity | NPD8479 | Phase 2 |
0.5945 | Remote Similarity | NPD4373 | Phase 2 |
0.5943 | Remote Similarity | NPD5293 | Phase 2 |
0.5943 | Remote Similarity | NPD1638 | Discovery |
0.5941 | Remote Similarity | NPD7393 | Clinical (unspecified phase) |
0.5941 | Remote Similarity | NPD3507 | Phase 2 |
0.5925 | Remote Similarity | NPD8246 | Approved |
0.5925 | Remote Similarity | NPD8247 | Approved |
0.5922 | Remote Similarity | NPD3074 | Discontinued |
0.5904 | Remote Similarity | NPD6824 | Clinical (unspecified phase) |
0.59 | Remote Similarity | NPD8291 | Clinical (unspecified phase) |
0.59 | Remote Similarity | NPD8375 | Approved |
0.5889 | Remote Similarity | NPD7589 | Clinical (unspecified phase) |
0.5889 | Remote Similarity | NPD4952 | Phase 3 |
0.5887 | Remote Similarity | NPD8463 | Approved |
0.5887 | Remote Similarity | NPD5850 | Phase 3 |
0.5873 | Remote Similarity | NPD4086 | Phase 1 |
0.5869 | Remote Similarity | NPD7417 | Discontinued |
0.5866 | Remote Similarity | NPD1867 | Approved |
0.5856 | Remote Similarity | NPD8371 | Clinical (unspecified phase) |
0.5851 | Remote Similarity | NPD4392 | Phase 2 |
0.585 | Remote Similarity | NPD8104 | Phase 3 |
0.5846 | Remote Similarity | NPD6716 | Phase 1 |
0.583 | Remote Similarity | NPD7885 | Phase 2 |
0.583 | Remote Similarity | NPD7886 | Phase 2 |
0.5827 | Remote Similarity | NPD6252 | Clinical (unspecified phase) |
0.5827 | Remote Similarity | NPD1480 | Clinical (unspecified phase) |
0.5827 | Remote Similarity | NPD8374 | Phase 3 |
0.5824 | Remote Similarity | NPD6495 | Clinical (unspecified phase) |
0.581 | Remote Similarity | NPD7994 | Phase 2 |
0.5806 | Remote Similarity | NPD7878 | Phase 2 |
0.5804 | Remote Similarity | NPD1505 | Phase 2 |
0.5802 | Remote Similarity | NPD5483 | Clinical (unspecified phase) |
0.5798 | Remote Similarity | NPD8329 | Phase 3 |
0.5797 | Remote Similarity | NPD7053 | Clinical (unspecified phase) |
0.5795 | Remote Similarity | NPD1955 | Discontinued |
0.5795 | Remote Similarity | NPD4369 | Phase 2 |
0.5789 | Remote Similarity | NPD8160 | Phase 2 |
0.5781 | Remote Similarity | NPD772 | Phase 3 |
0.5779 | Remote Similarity | NPD4900 | Clinical (unspecified phase) |
0.5765 | Remote Similarity | NPD5479 | Discontinued |
0.5765 | Remote Similarity | NPD1659 | Phase 1 |
0.5751 | Remote Similarity | NPD5450 | Discontinued |
0.573 | Remote Similarity | NPD5857 | Phase 3 |
0.573 | Remote Similarity | NPD6023 | Discontinued |
0.5725 | Remote Similarity | NPD4322 | Discontinued |
0.572 | Remote Similarity | NPD5817 | Discontinued |
0.572 | Remote Similarity | NPD7796 | Approved |
0.572 | Remote Similarity | NPD7797 | Approved |
0.5719 | Remote Similarity | NPD8421 | Discontinued |
0.5714 | Remote Similarity | NPD53 | Approved |
0.5714 | Remote Similarity | NPD7777 | Approved |
0.5714 | Remote Similarity | NPD7778 | Approved |
0.5709 | Remote Similarity | NPD8289 | Discontinued |
0.5709 | Remote Similarity | NPD5887 | Clinical (unspecified phase) |
0.5709 | Remote Similarity | NPD1927 | Discontinued |
0.5703 | Remote Similarity | NPD8327 | Clinical (unspecified phase) |
0.5703 | Remote Similarity | NPD8326 | Phase 3 |
0.5703 | Remote Similarity | NPD8325 | Phase 3 |
0.5698 | Remote Similarity | NPD6741 | Clinical (unspecified phase) |
0.5694 | Remote Similarity | NPD8107 | Approved |
0.5693 | Remote Similarity | NPD7803 | Approved |
0.5691 | Remote Similarity | NPD7070 | Clinical (unspecified phase) |
0.5691 | Remote Similarity | NPD7703 | Clinical (unspecified phase) |
0.5691 | Remote Similarity | NPD5416 | Discontinued |
0.5686 | Remote Similarity | NPD3259 | Approved |
0.5681 | Remote Similarity | NPD6962 | Phase 2 |
0.568 | Remote Similarity | NPD5632 | Approved |
0.5679 | Remote Similarity | NPD8108 | Approved |
0.5674 | Remote Similarity | NPD7416 | Clinical (unspecified phase) |
0.5662 | Remote Similarity | NPD7708 | Approved |
0.566 | Remote Similarity | NPD8359 | Phase 2 |
0.5658 | Remote Similarity | NPD6627 | Discontinued |
0.5654 | Remote Similarity | NPD8460 | Approved |
0.5654 | Remote Similarity | NPD8459 | Approved |
0.5651 | Remote Similarity | NPD8253 | Phase 3 |
0.565 | Remote Similarity | NPD1166 | Clinical (unspecified phase) |
0.565 | Remote Similarity | NPD5726 | Clinical (unspecified phase) |
0.5641 | Remote Similarity | NPD4334 | Discontinued |
0.5628 | Remote Similarity | NPD7470 | Discontinued |
0.5627 | Remote Similarity | NPD5499 | Approved |
0.5627 | Remote Similarity | NPD6790 | Phase 1 |
0.5625 | Remote Similarity | NPD7955 | Approved |
0.5625 | Remote Similarity | NPD7956 | Approved |
0.5622 | Remote Similarity | NPD7538 | Clinical (unspecified phase) |
0.5622 | Remote Similarity | NPD5417 | Clinical (unspecified phase) |
0.562 | Remote Similarity | NPD8372 | Clinical (unspecified phase) |
0.562 | Remote Similarity | NPD5461 | Discontinued |
0.5618 | Remote Similarity | NPD4896 | Clinical (unspecified phase) |
0.5618 | Remote Similarity | NPD6231 | Phase 3 |
0.5618 | Remote Similarity | NPD6198 | Phase 1 |
0.5615 | Remote Similarity | NPD4901 | Clinical (unspecified phase) |
0.5609 | Remote Similarity | NPD8049 | Phase 2 |
0.5605 | Remote Similarity | NPD8097 | Phase 3 |
0.5605 | Remote Similarity | NPD8096 | Phase 3 |
0.5605 | Remote Similarity | NPD7605 | Discovery |
0.5603 | Remote Similarity | NPD7710 | Clinical (unspecified phase) |
PubChem CID   | 45268860 |
ChEMBL   | CHEMBL554622 |
ZINC   |
Molecular Weight:   | 854.47 |
ALogP:   | -1.8696 |
MLogP:   | 4.65 |
XLogP:   | 3.426 |
# Rotatable Bonds:   | 26 |
Polar Surface Area:   | 209.92 |
# H-Bond Aceptor:   | 13 |
# H-Bond Donor:   | 2 |
# Rings:   | 4 |
# Heavy Atoms:   | 61 |