Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT91 | Cell Line | KB | Homo sapiens | ED50 | = | 5 | umol/ml | 11325240 |
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 NPC98557 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 | NPC167881 |
0.9733 | High Similarity | NPC24417 |
0.9605 | High Similarity | NPC229825 |
0.9595 | High Similarity | NPC471465 |
0.9595 | High Similarity | NPC196653 |
0.9481 | High Similarity | NPC59097 |
0.9481 | High Similarity | NPC40746 |
0.9481 | High Similarity | NPC473390 |
0.9481 | High Similarity | NPC169575 |
0.9481 | High Similarity | NPC131669 |
0.9359 | High Similarity | NPC96259 |
0.9359 | High Similarity | NPC141193 |
0.9359 | High Similarity | NPC158756 |
0.9359 | High Similarity | NPC476804 |
0.9359 | High Similarity | NPC191476 |
0.9359 | High Similarity | NPC114979 |
0.9241 | High Similarity | NPC255307 |
0.9241 | High Similarity | NPC470755 |
0.9221 | High Similarity | NPC52861 |
0.92 | High Similarity | NPC320630 |
0.92 | High Similarity | NPC141789 |
0.92 | High Similarity | NPC116177 |
0.92 | High Similarity | NPC476028 |
0.92 | High Similarity | NPC7563 |
0.92 | High Similarity | NPC171204 |
0.9178 | High Similarity | NPC295633 |
0.9178 | High Similarity | NPC269206 |
0.9178 | High Similarity | NPC58956 |
0.9125 | High Similarity | NPC475461 |
0.9125 | High Similarity | NPC469910 |
0.9125 | High Similarity | NPC305475 |
0.9067 | High Similarity | NPC68819 |
0.8961 | High Similarity | NPC270126 |
0.8902 | High Similarity | NPC473715 |
0.8902 | High Similarity | NPC476805 |
0.8902 | High Similarity | NPC476803 |
0.8902 | High Similarity | NPC475819 |
0.8889 | High Similarity | NPC150755 |
0.8846 | High Similarity | NPC281132 |
0.8831 | High Similarity | NPC108816 |
0.8831 | High Similarity | NPC93763 |
0.8831 | High Similarity | NPC267231 |
0.8816 | High Similarity | NPC235906 |
0.8784 | High Similarity | NPC163003 |
0.8765 | High Similarity | NPC165162 |
0.875 | High Similarity | NPC116543 |
0.8718 | High Similarity | NPC470239 |
0.8718 | High Similarity | NPC89128 |
0.8718 | High Similarity | NPC470244 |
0.8701 | High Similarity | NPC97516 |
0.869 | High Similarity | NPC473619 |
0.869 | High Similarity | NPC469368 |
0.869 | High Similarity | NPC475855 |
0.869 | High Similarity | NPC474232 |
0.8684 | High Similarity | NPC155587 |
0.8625 | High Similarity | NPC89555 |
0.8588 | High Similarity | NPC473321 |
0.8553 | High Similarity | NPC140287 |
0.8553 | High Similarity | NPC476355 |
0.8533 | High Similarity | NPC129665 |
0.8488 | Intermediate Similarity | NPC295204 |
0.8488 | Intermediate Similarity | NPC162205 |
0.8488 | Intermediate Similarity | NPC288240 |
0.8488 | Intermediate Similarity | NPC228451 |
0.8488 | Intermediate Similarity | NPC273579 |
0.8488 | Intermediate Similarity | NPC125674 |
0.8488 | Intermediate Similarity | NPC475302 |
0.8488 | Intermediate Similarity | NPC475838 |
0.8471 | Intermediate Similarity | NPC179394 |
0.8471 | Intermediate Similarity | NPC144133 |
0.8462 | Intermediate Similarity | NPC474760 |
0.8391 | Intermediate Similarity | NPC303942 |
0.8391 | Intermediate Similarity | NPC57405 |
0.8391 | Intermediate Similarity | NPC474247 |
0.8353 | Intermediate Similarity | NPC474032 |
0.8333 | Intermediate Similarity | NPC123360 |
0.8313 | Intermediate Similarity | NPC21469 |
0.8312 | Intermediate Similarity | NPC114727 |
0.8312 | Intermediate Similarity | NPC476590 |
0.8312 | Intermediate Similarity | NPC48641 |
0.8295 | Intermediate Similarity | NPC471142 |
0.8295 | Intermediate Similarity | NPC477922 |
0.8293 | Intermediate Similarity | NPC250315 |
0.8272 | Intermediate Similarity | NPC301477 |
0.8272 | Intermediate Similarity | NPC141810 |
0.8272 | Intermediate Similarity | NPC25684 |
0.8272 | Intermediate Similarity | NPC281949 |
0.8256 | Intermediate Similarity | NPC129419 |
0.825 | Intermediate Similarity | NPC617 |
0.8235 | Intermediate Similarity | NPC477302 |
0.8235 | Intermediate Similarity | NPC136879 |
0.8228 | Intermediate Similarity | NPC41780 |
0.8228 | Intermediate Similarity | NPC187568 |
0.8228 | Intermediate Similarity | NPC65603 |
0.8214 | Intermediate Similarity | NPC50637 |
0.8205 | Intermediate Similarity | NPC193351 |
0.8205 | Intermediate Similarity | NPC138408 |
0.8205 | Intermediate Similarity | NPC226669 |
0.8202 | Intermediate Similarity | NPC477921 |
0.8202 | Intermediate Similarity | NPC306041 |
0.8202 | Intermediate Similarity | NPC230800 |
0.8202 | Intermediate Similarity | NPC473859 |
0.8202 | Intermediate Similarity | NPC279621 |
0.814 | Intermediate Similarity | NPC206001 |
0.814 | Intermediate Similarity | NPC268298 |
0.814 | Intermediate Similarity | NPC218927 |
0.8118 | Intermediate Similarity | NPC266957 |
0.809 | Intermediate Similarity | NPC475659 |
0.809 | Intermediate Similarity | NPC471141 |
0.8072 | Intermediate Similarity | NPC474703 |
0.8068 | Intermediate Similarity | NPC475912 |
0.8049 | Intermediate Similarity | NPC470241 |
0.8049 | Intermediate Similarity | NPC325031 |
0.8025 | Intermediate Similarity | NPC19841 |
0.8025 | Intermediate Similarity | NPC178277 |
0.8025 | Intermediate Similarity | NPC475210 |
0.8023 | Intermediate Similarity | NPC202672 |
0.8022 | Intermediate Similarity | NPC471144 |
0.8022 | Intermediate Similarity | NPC473326 |
0.8 | Intermediate Similarity | NPC470240 |
0.8 | Intermediate Similarity | NPC469483 |
0.8 | Intermediate Similarity | NPC476794 |
0.8 | Intermediate Similarity | NPC194871 |
0.7976 | Intermediate Similarity | NPC156485 |
0.7976 | Intermediate Similarity | NPC82297 |
0.7975 | Intermediate Similarity | NPC329852 |
0.7955 | Intermediate Similarity | NPC184463 |
0.7955 | Intermediate Similarity | NPC30515 |
0.7955 | Intermediate Similarity | NPC131209 |
0.7952 | Intermediate Similarity | NPC474252 |
0.7935 | Intermediate Similarity | NPC475949 |
0.7935 | Intermediate Similarity | NPC288876 |
0.7931 | Intermediate Similarity | NPC166919 |
0.7931 | Intermediate Similarity | NPC295312 |
0.7922 | Intermediate Similarity | NPC67183 |
0.7907 | Intermediate Similarity | NPC160138 |
0.7895 | Intermediate Similarity | NPC470256 |
0.7889 | Intermediate Similarity | NPC14961 |
0.7889 | Intermediate Similarity | NPC36954 |
0.7889 | Intermediate Similarity | NPC52044 |
0.7889 | Intermediate Similarity | NPC270013 |
0.7889 | Intermediate Similarity | NPC304886 |
0.7882 | Intermediate Similarity | NPC261380 |
0.7882 | Intermediate Similarity | NPC50362 |
0.7882 | Intermediate Similarity | NPC38468 |
0.7882 | Intermediate Similarity | NPC319795 |
0.7865 | Intermediate Similarity | NPC469692 |
0.7865 | Intermediate Similarity | NPC179746 |
0.7865 | Intermediate Similarity | NPC212486 |
0.7865 | Intermediate Similarity | NPC476300 |
0.7865 | Intermediate Similarity | NPC81419 |
0.7865 | Intermediate Similarity | NPC469645 |
0.7848 | Intermediate Similarity | NPC472966 |
0.7841 | Intermediate Similarity | NPC51004 |
0.7831 | Intermediate Similarity | NPC471325 |
0.7816 | Intermediate Similarity | NPC277771 |
0.7816 | Intermediate Similarity | NPC287089 |
0.7805 | Intermediate Similarity | NPC182550 |
0.7805 | Intermediate Similarity | NPC63649 |
0.7805 | Intermediate Similarity | NPC264227 |
0.7805 | Intermediate Similarity | NPC472965 |
0.7802 | Intermediate Similarity | NPC476315 |
0.7792 | Intermediate Similarity | NPC476591 |
0.7792 | Intermediate Similarity | NPC88877 |
0.7791 | Intermediate Similarity | NPC107787 |
0.7791 | Intermediate Similarity | NPC261721 |
0.7778 | Intermediate Similarity | NPC323008 |
0.7778 | Intermediate Similarity | NPC474278 |
0.7778 | Intermediate Similarity | NPC262133 |
0.7778 | Intermediate Similarity | NPC470010 |
0.7778 | Intermediate Similarity | NPC474035 |
0.7778 | Intermediate Similarity | NPC121825 |
0.7778 | Intermediate Similarity | NPC470013 |
0.7778 | Intermediate Similarity | NPC477131 |
0.7778 | Intermediate Similarity | NPC57744 |
0.7778 | Intermediate Similarity | NPC474338 |
0.7778 | Intermediate Similarity | NPC81386 |
0.7766 | Intermediate Similarity | NPC471148 |
0.7765 | Intermediate Similarity | NPC165287 |
0.7765 | Intermediate Similarity | NPC159635 |
0.7765 | Intermediate Similarity | NPC115786 |
0.7753 | Intermediate Similarity | NPC261607 |
0.7753 | Intermediate Similarity | NPC208886 |
0.7753 | Intermediate Similarity | NPC300312 |
0.7753 | Intermediate Similarity | NPC233345 |
0.7753 | Intermediate Similarity | NPC186363 |
0.7753 | Intermediate Similarity | NPC111114 |
0.7753 | Intermediate Similarity | NPC12172 |
0.7753 | Intermediate Similarity | NPC133698 |
0.7738 | Intermediate Similarity | NPC85772 |
0.7738 | Intermediate Similarity | NPC173609 |
0.7738 | Intermediate Similarity | NPC474291 |
0.7727 | Intermediate Similarity | NPC151770 |
0.7727 | Intermediate Similarity | NPC307411 |
0.7717 | Intermediate Similarity | NPC161493 |
0.7711 | Intermediate Similarity | NPC276356 |
0.7711 | Intermediate Similarity | NPC302426 |
0.7701 | Intermediate Similarity | NPC178215 |
0.7701 | Intermediate Similarity | NPC237540 |
0.7692 | Intermediate Similarity | NPC213698 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC98557 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 |
---|---|---|---|
0.7882 | Intermediate Similarity | NPD1733 | Clinical (unspecified phase) |
0.7692 | Intermediate Similarity | NPD1698 | Clinical (unspecified phase) |
0.7444 | Intermediate Similarity | NPD6698 | Approved |
0.7444 | Intermediate Similarity | NPD46 | Approved |
0.7442 | Intermediate Similarity | NPD7154 | Phase 3 |
0.7333 | Intermediate Similarity | NPD1695 | Approved |
0.7294 | Intermediate Similarity | NPD5790 | Clinical (unspecified phase) |
0.7253 | Intermediate Similarity | NPD5785 | Approved |
0.7079 | Intermediate Similarity | NPD6082 | Clinical (unspecified phase) |
0.7079 | Intermediate Similarity | NPD5363 | Approved |
0.7079 | Intermediate Similarity | NPD1694 | Approved |
0.7059 | Intermediate Similarity | NPD4268 | Approved |
0.7059 | Intermediate Similarity | NPD4271 | Approved |
0.7045 | Intermediate Similarity | NPD5362 | Discontinued |
0.7 | Intermediate Similarity | NPD4249 | Approved |
0.6932 | Remote Similarity | NPD4270 | Approved |
0.6932 | Remote Similarity | NPD6435 | Approved |
0.6932 | Remote Similarity | NPD4269 | Approved |
0.6931 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6923 | Remote Similarity | NPD4251 | Approved |
0.6923 | Remote Similarity | NPD4250 | Approved |
0.6907 | Remote Similarity | NPD4225 | Approved |
0.6897 | Remote Similarity | NPD4252 | Approved |
0.6897 | Remote Similarity | NPD4820 | Approved |
0.6897 | Remote Similarity | NPD4821 | Approved |
0.6897 | Remote Similarity | NPD4819 | Approved |
0.6897 | Remote Similarity | NPD4822 | Approved |
0.6882 | Remote Similarity | NPD7838 | Discovery |
0.6818 | Remote Similarity | NPD5369 | Approved |
0.6813 | Remote Similarity | NPD5786 | Approved |
0.6809 | Remote Similarity | NPD7983 | Approved |
0.6742 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.6731 | Remote Similarity | NPD6371 | Approved |
0.6705 | Remote Similarity | NPD5368 | Approved |
0.6667 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6625 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.6566 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6562 | Remote Similarity | NPD5779 | Approved |
0.6562 | Remote Similarity | NPD5778 | Approved |
0.6556 | Remote Similarity | NPD5209 | Approved |
0.6538 | Remote Similarity | NPD6686 | Approved |
0.6512 | Remote Similarity | NPD8039 | Approved |
0.6509 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6484 | Remote Similarity | NPD5332 | Approved |
0.6484 | Remote Similarity | NPD5331 | Approved |
0.6444 | Remote Similarity | NPD4790 | Discontinued |
0.6421 | Remote Similarity | NPD5370 | Suspended |
0.6421 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.6421 | Remote Similarity | NPD6101 | Approved |
0.6413 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6392 | Remote Similarity | NPD6399 | Phase 3 |
0.6364 | Remote Similarity | NPD7839 | Suspended |
0.6364 | Remote Similarity | NPD4756 | Discovery |
0.6329 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.6327 | Remote Similarity | NPD5282 | Discontinued |
0.6296 | Remote Similarity | NPD3197 | Phase 1 |
0.6296 | Remote Similarity | NPD6053 | Discontinued |
0.6289 | Remote Similarity | NPD6411 | Approved |
0.6289 | Remote Similarity | NPD4810 | Clinical (unspecified phase) |
0.6238 | Remote Similarity | NPD7638 | Approved |
0.6216 | Remote Similarity | NPD7115 | Discovery |
0.6176 | Remote Similarity | NPD7639 | Approved |
0.6176 | Remote Similarity | NPD7640 | Approved |
0.6122 | Remote Similarity | NPD7637 | Suspended |
0.6117 | Remote Similarity | NPD5344 | Discontinued |
0.6105 | Remote Similarity | NPD6422 | Discontinued |
0.6071 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.6053 | Remote Similarity | NPD3172 | Approved |
0.6049 | Remote Similarity | NPD368 | Approved |
0.6022 | Remote Similarity | NPD3667 | Approved |
0.6 | Remote Similarity | NPD8516 | Approved |
0.6 | Remote Similarity | NPD8515 | Approved |
0.6 | Remote Similarity | NPD8513 | Phase 3 |
0.6 | Remote Similarity | NPD8517 | Approved |
0.6 | Remote Similarity | NPD6927 | Phase 3 |
0.5981 | Remote Similarity | NPD5697 | Approved |
0.598 | Remote Similarity | NPD7902 | Approved |
0.598 | Remote Similarity | NPD6083 | Phase 2 |
0.598 | Remote Similarity | NPD6084 | Phase 2 |
0.5974 | Remote Similarity | NPD4266 | Approved |
0.5974 | Remote Similarity | NPD3196 | Approved |
0.5974 | Remote Similarity | NPD3195 | Phase 2 |
0.5974 | Remote Similarity | NPD3194 | Approved |
0.5952 | Remote Similarity | NPD7331 | Phase 2 |
0.5941 | Remote Similarity | NPD5695 | Phase 3 |
0.5938 | Remote Similarity | NPD7146 | Approved |
0.5938 | Remote Similarity | NPD7521 | Approved |
0.5938 | Remote Similarity | NPD6684 | Approved |
0.5938 | Remote Similarity | NPD5330 | Approved |
0.5938 | Remote Similarity | NPD3618 | Phase 1 |
0.5938 | Remote Similarity | NPD7334 | Approved |
0.5938 | Remote Similarity | NPD6409 | Approved |
0.5926 | Remote Similarity | NPD6881 | Approved |
0.5926 | Remote Similarity | NPD6899 | Approved |
0.5922 | Remote Similarity | NPD5696 | Approved |
0.5909 | Remote Similarity | NPD6650 | Approved |
0.5909 | Remote Similarity | NPD6649 | Approved |
0.5897 | Remote Similarity | NPD342 | Phase 1 |
0.5895 | Remote Similarity | NPD3665 | Phase 1 |
0.5895 | Remote Similarity | NPD4786 | Approved |
0.5895 | Remote Similarity | NPD3133 | Approved |
0.5895 | Remote Similarity | NPD3666 | Approved |
0.5888 | Remote Similarity | NPD5739 | Approved |
0.5888 | Remote Similarity | NPD7128 | Approved |
0.5888 | Remote Similarity | NPD6675 | Approved |
0.5888 | Remote Similarity | NPD6402 | Approved |
0.5872 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.5872 | Remote Similarity | NPD6014 | Approved |
0.5872 | Remote Similarity | NPD6372 | Approved |
0.5872 | Remote Similarity | NPD6013 | Approved |
0.5872 | Remote Similarity | NPD6012 | Approved |
0.5872 | Remote Similarity | NPD6373 | Approved |
0.5865 | Remote Similarity | NPD6648 | Approved |
0.5849 | Remote Similarity | NPD6647 | Phase 2 |
0.5842 | Remote Similarity | NPD7748 | Approved |
0.5833 | Remote Similarity | NPD5701 | Approved |
0.5818 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.5818 | Remote Similarity | NPD7102 | Approved |
0.5818 | Remote Similarity | NPD7290 | Approved |
0.5818 | Remote Similarity | NPD6883 | Approved |
0.5816 | Remote Similarity | NPD6903 | Approved |
0.5816 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.58 | Remote Similarity | NPD7515 | Phase 2 |
0.5789 | Remote Similarity | NPD6110 | Phase 1 |
0.5783 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.578 | Remote Similarity | NPD6011 | Approved |
0.578 | Remote Similarity | NPD7320 | Approved |
0.5773 | Remote Similarity | NPD5279 | Phase 3 |
0.5766 | Remote Similarity | NPD6869 | Approved |
0.5766 | Remote Similarity | NPD6847 | Approved |
0.5766 | Remote Similarity | NPD2204 | Approved |
0.5766 | Remote Similarity | NPD2181 | Clinical (unspecified phase) |
0.5766 | Remote Similarity | NPD6617 | Approved |
0.5766 | Remote Similarity | NPD8130 | Phase 1 |
0.5765 | Remote Similarity | NPD3704 | Approved |
0.5761 | Remote Similarity | NPD3732 | Approved |
0.575 | Remote Similarity | NPD8074 | Phase 3 |
0.5733 | Remote Similarity | NPD3173 | Approved |
0.5728 | Remote Similarity | NPD4792 | Clinical (unspecified phase) |
0.5728 | Remote Similarity | NPD4228 | Discovery |
0.5714 | Remote Similarity | NPD6882 | Approved |
0.5714 | Remote Similarity | NPD8297 | Approved |
0.5686 | Remote Similarity | NPD7900 | Approved |
0.5686 | Remote Similarity | NPD7901 | Clinical (unspecified phase) |
0.5676 | Remote Similarity | NPD6421 | Discontinued |
0.5676 | Remote Similarity | NPD2067 | Discontinued |
0.567 | Remote Similarity | NPD1696 | Phase 3 |
0.5657 | Remote Similarity | NPD6672 | Approved |
0.5657 | Remote Similarity | NPD5737 | Approved |
0.5647 | Remote Similarity | NPD7341 | Phase 2 |
0.5644 | Remote Similarity | NPD5281 | Approved |
0.5644 | Remote Similarity | NPD8034 | Phase 2 |
0.5644 | Remote Similarity | NPD6079 | Approved |
0.5644 | Remote Similarity | NPD5693 | Phase 1 |
0.5644 | Remote Similarity | NPD5284 | Approved |
0.5644 | Remote Similarity | NPD8035 | Phase 2 |
0.5638 | Remote Similarity | NPD4695 | Discontinued |
0.5631 | Remote Similarity | NPD4629 | Approved |
0.5631 | Remote Similarity | NPD5210 | Approved |
0.563 | Remote Similarity | NPD7642 | Approved |
0.563 | Remote Similarity | NPD7829 | Approved |
0.563 | Remote Similarity | NPD7830 | Approved |
0.5625 | Remote Similarity | NPD7116 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD3198 | Approved |
0.5607 | Remote Similarity | NPD5211 | Phase 2 |
0.5607 | Remote Similarity | NPD7632 | Discontinued |
0.5603 | Remote Similarity | NPD7641 | Discontinued |
0.56 | Remote Similarity | NPD4753 | Phase 2 |
0.56 | Remote Similarity | NPD622 | Approved |
0.56 | Remote Similarity | NPD5328 | Approved |
PubChem CID   | 5281460 |
ChEMBL   | CHEMBL485296 |
ZINC   |
Molecular Weight:   | 248.14 |
ALogP:   | 1.7624 |
MLogP:   | 2.78 |
XLogP:   | 1.856 |
# Rotatable Bonds:   | 3 |
Polar Surface Area:   | 46.53 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 1 |
# Rings:   | 2 |
# Heavy Atoms:   | 18 |