Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT602 | Organism | Mycobacterium smegmatis | Mycobacterium smegmatis | MIC | = | 180000 | nM | 22413887 |
NPT1177 | Organism | Mycobacterium phlei | Mycobacterium phlei | MIC | = | 180000 | nM | DrugMatrix in vitro pharmacology data |
NPT4585 | Organism | Mycobacterium diernhoferi | Mycobacterium diernhoferi | MIC | = | 180000 | nM | 20112995 |
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 NPC474312 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 |
---|---|---|
0.8289 | Intermediate Similarity | NPC474298 |
0.8289 | Intermediate Similarity | NPC475808 |
0.8289 | Intermediate Similarity | NPC474299 |
0.8289 | Intermediate Similarity | NPC473985 |
0.8289 | Intermediate Similarity | NPC28348 |
0.8049 | Intermediate Similarity | NPC474833 |
0.7821 | Intermediate Similarity | NPC474812 |
0.7667 | Intermediate Similarity | NPC39290 |
0.7667 | Intermediate Similarity | NPC159369 |
0.7632 | Intermediate Similarity | NPC316674 |
0.75 | Intermediate Similarity | NPC291196 |
0.75 | Intermediate Similarity | NPC103712 |
0.7374 | Intermediate Similarity | NPC74035 |
0.7349 | Intermediate Similarity | NPC288086 |
0.73 | Intermediate Similarity | NPC475918 |
0.7262 | Intermediate Similarity | NPC217095 |
0.7262 | Intermediate Similarity | NPC264417 |
0.7237 | Intermediate Similarity | NPC326524 |
0.7237 | Intermediate Similarity | NPC325550 |
0.7237 | Intermediate Similarity | NPC329003 |
0.7143 | Intermediate Similarity | NPC233932 |
0.7105 | Intermediate Similarity | NPC325734 |
0.7105 | Intermediate Similarity | NPC321030 |
0.7073 | Intermediate Similarity | NPC280065 |
0.7073 | Intermediate Similarity | NPC45060 |
0.7024 | Intermediate Similarity | NPC43219 |
0.7021 | Intermediate Similarity | NPC43074 |
0.7021 | Intermediate Similarity | NPC209047 |
0.7021 | Intermediate Similarity | NPC74672 |
0.7021 | Intermediate Similarity | NPC139782 |
0.7021 | Intermediate Similarity | NPC242503 |
0.6966 | Remote Similarity | NPC82799 |
0.6952 | Remote Similarity | NPC476875 |
0.6951 | Remote Similarity | NPC249713 |
0.6947 | Remote Similarity | NPC473950 |
0.6947 | Remote Similarity | NPC15851 |
0.6947 | Remote Similarity | NPC473604 |
0.6947 | Remote Similarity | NPC475603 |
0.6947 | Remote Similarity | NPC182632 |
0.6947 | Remote Similarity | NPC111567 |
0.6947 | Remote Similarity | NPC61894 |
0.6947 | Remote Similarity | NPC263545 |
0.6947 | Remote Similarity | NPC186840 |
0.6947 | Remote Similarity | NPC475125 |
0.6947 | Remote Similarity | NPC319473 |
0.6947 | Remote Similarity | NPC473581 |
0.6947 | Remote Similarity | NPC309898 |
0.6947 | Remote Similarity | NPC282705 |
0.6941 | Remote Similarity | NPC86064 |
0.6869 | Remote Similarity | NPC132931 |
0.6867 | Remote Similarity | NPC470436 |
0.6863 | Remote Similarity | NPC14537 |
0.6837 | Remote Similarity | NPC175614 |
0.6832 | Remote Similarity | NPC72401 |
0.6832 | Remote Similarity | NPC325339 |
0.6824 | Remote Similarity | NPC470435 |
0.6804 | Remote Similarity | NPC256570 |
0.6804 | Remote Similarity | NPC3568 |
0.6804 | Remote Similarity | NPC35269 |
0.6804 | Remote Similarity | NPC157353 |
0.6804 | Remote Similarity | NPC70323 |
0.6804 | Remote Similarity | NPC17290 |
0.6804 | Remote Similarity | NPC192066 |
0.6804 | Remote Similarity | NPC23454 |
0.6804 | Remote Similarity | NPC156782 |
0.6804 | Remote Similarity | NPC54961 |
0.6804 | Remote Similarity | NPC262312 |
0.6804 | Remote Similarity | NPC158445 |
0.6804 | Remote Similarity | NPC282088 |
0.6796 | Remote Similarity | NPC473252 |
0.6789 | Remote Similarity | NPC201968 |
0.6774 | Remote Similarity | NPC477728 |
0.6762 | Remote Similarity | NPC329305 |
0.6739 | Remote Similarity | NPC477199 |
0.6711 | Remote Similarity | NPC242930 |
0.6707 | Remote Similarity | NPC113224 |
0.6706 | Remote Similarity | NPC477643 |
0.6706 | Remote Similarity | NPC477641 |
0.6706 | Remote Similarity | NPC320865 |
0.67 | Remote Similarity | NPC234542 |
0.6699 | Remote Similarity | NPC205176 |
0.6667 | Remote Similarity | NPC45313 |
0.6667 | Remote Similarity | NPC197294 |
0.6667 | Remote Similarity | NPC478256 |
0.6667 | Remote Similarity | NPC183449 |
0.6667 | Remote Similarity | NPC8098 |
0.6667 | Remote Similarity | NPC477642 |
0.6637 | Remote Similarity | NPC45777 |
0.6637 | Remote Similarity | NPC477061 |
0.6635 | Remote Similarity | NPC201128 |
0.6634 | Remote Similarity | NPC473224 |
0.663 | Remote Similarity | NPC178758 |
0.663 | Remote Similarity | NPC196102 |
0.6627 | Remote Similarity | NPC330426 |
0.6627 | Remote Similarity | NPC148192 |
0.6627 | Remote Similarity | NPC104537 |
0.6627 | Remote Similarity | NPC22101 |
0.6627 | Remote Similarity | NPC127091 |
0.6627 | Remote Similarity | NPC271921 |
0.6625 | Remote Similarity | NPC328776 |
0.6625 | Remote Similarity | NPC321838 |
0.6625 | Remote Similarity | NPC201939 |
0.6625 | Remote Similarity | NPC320305 |
0.6606 | Remote Similarity | NPC50694 |
0.6602 | Remote Similarity | NPC476877 |
0.6588 | Remote Similarity | NPC42526 |
0.6548 | Remote Similarity | NPC48218 |
0.6548 | Remote Similarity | NPC141481 |
0.6548 | Remote Similarity | NPC473559 |
0.6548 | Remote Similarity | NPC324981 |
0.6522 | Remote Similarity | NPC477730 |
0.6522 | Remote Similarity | NPC477487 |
0.6517 | Remote Similarity | NPC316242 |
0.6517 | Remote Similarity | NPC325936 |
0.6505 | Remote Similarity | NPC477198 |
0.65 | Remote Similarity | NPC243532 |
0.65 | Remote Similarity | NPC475503 |
0.6496 | Remote Similarity | NPC477793 |
0.6496 | Remote Similarity | NPC329919 |
0.6494 | Remote Similarity | NPC52264 |
0.6491 | Remote Similarity | NPC273185 |
0.6481 | Remote Similarity | NPC29501 |
0.6477 | Remote Similarity | NPC3094 |
0.6476 | Remote Similarity | NPC476876 |
0.6463 | Remote Similarity | NPC68343 |
0.6463 | Remote Similarity | NPC328089 |
0.6455 | Remote Similarity | NPC471645 |
0.6452 | Remote Similarity | NPC145748 |
0.6452 | Remote Similarity | NPC155670 |
0.6452 | Remote Similarity | NPC228638 |
0.6452 | Remote Similarity | NPC95478 |
0.6449 | Remote Similarity | NPC473578 |
0.6444 | Remote Similarity | NPC473984 |
0.6444 | Remote Similarity | NPC478017 |
0.6444 | Remote Similarity | NPC315535 |
0.6444 | Remote Similarity | NPC315131 |
0.6437 | Remote Similarity | NPC314678 |
0.6429 | Remote Similarity | NPC475443 |
0.6429 | Remote Similarity | NPC473829 |
0.6421 | Remote Similarity | NPC258824 |
0.6395 | Remote Similarity | NPC476660 |
0.6386 | Remote Similarity | NPC476657 |
0.6386 | Remote Similarity | NPC476655 |
0.6386 | Remote Similarity | NPC476654 |
0.6383 | Remote Similarity | NPC227051 |
0.6364 | Remote Similarity | NPC137538 |
0.6355 | Remote Similarity | NPC475150 |
0.6355 | Remote Similarity | NPC171734 |
0.6341 | Remote Similarity | NPC29697 |
0.6341 | Remote Similarity | NPC145658 |
0.6341 | Remote Similarity | NPC477106 |
0.6337 | Remote Similarity | NPC123141 |
0.633 | Remote Similarity | NPC12270 |
0.6322 | Remote Similarity | NPC293114 |
0.6322 | Remote Similarity | NPC474403 |
0.631 | Remote Similarity | NPC476656 |
0.631 | Remote Similarity | NPC476659 |
0.6306 | Remote Similarity | NPC103391 |
0.6306 | Remote Similarity | NPC472536 |
0.6296 | Remote Similarity | NPC321919 |
0.6296 | Remote Similarity | NPC81896 |
0.6296 | Remote Similarity | NPC298484 |
0.6296 | Remote Similarity | NPC477644 |
0.6292 | Remote Similarity | NPC327041 |
0.6292 | Remote Similarity | NPC285840 |
0.6292 | Remote Similarity | NPC260396 |
0.6279 | Remote Similarity | NPC473772 |
0.6279 | Remote Similarity | NPC476285 |
0.6279 | Remote Similarity | NPC476291 |
0.6275 | Remote Similarity | NPC475646 |
0.6273 | Remote Similarity | NPC469865 |
0.6265 | Remote Similarity | NPC476658 |
0.6264 | Remote Similarity | NPC182292 |
0.625 | Remote Similarity | NPC327383 |
0.625 | Remote Similarity | NPC185186 |
0.625 | Remote Similarity | NPC329914 |
0.625 | Remote Similarity | NPC305223 |
0.625 | Remote Similarity | NPC329890 |
0.6235 | Remote Similarity | NPC26500 |
0.6235 | Remote Similarity | NPC99619 |
0.6228 | Remote Similarity | NPC169328 |
0.6224 | Remote Similarity | NPC477729 |
0.622 | Remote Similarity | NPC325929 |
0.622 | Remote Similarity | NPC47333 |
0.622 | Remote Similarity | NPC271282 |
0.622 | Remote Similarity | NPC66460 |
0.622 | Remote Similarity | NPC29468 |
0.6207 | Remote Similarity | NPC97614 |
0.6207 | Remote Similarity | NPC315199 |
0.6196 | Remote Similarity | NPC157173 |
0.619 | Remote Similarity | NPC477525 |
0.618 | Remote Similarity | NPC474321 |
0.6174 | Remote Similarity | NPC310467 |
0.617 | Remote Similarity | NPC469833 |
0.617 | Remote Similarity | NPC469838 |
0.6168 | Remote Similarity | NPC271269 |
0.6168 | Remote Similarity | NPC258130 |
0.6163 | Remote Similarity | NPC209327 |
0.6163 | Remote Similarity | NPC273508 |
0.6162 | Remote Similarity | NPC319021 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC474312 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 |
---|---|---|---|
0.7021 | Intermediate Similarity | NPD8522 | Clinical (unspecified phase) |
0.701 | Intermediate Similarity | NPD4228 | Discovery |
0.6923 | Remote Similarity | NPD6413 | Approved |
0.6875 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.6857 | Remote Similarity | NPD6421 | Discontinued |
0.6706 | Remote Similarity | NPD2256 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD6095 | Approved |
0.6667 | Remote Similarity | NPD6094 | Approved |
0.6444 | Remote Similarity | NPD3732 | Approved |
0.6444 | Remote Similarity | NPD7917 | Clinical (unspecified phase) |
0.6444 | Remote Similarity | NPD7918 | Clinical (unspecified phase) |
0.633 | Remote Similarity | NPD1719 | Phase 1 |
0.63 | Remote Similarity | NPD8394 | Approved |
0.6222 | Remote Similarity | NPD818 | Approved |
0.6222 | Remote Similarity | NPD819 | Approved |
0.6163 | Remote Similarity | NPD3724 | Clinical (unspecified phase) |
0.6145 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6091 | Remote Similarity | NPD6420 | Discontinued |
0.6071 | Remote Similarity | NPD3197 | Phase 1 |
0.6019 | Remote Similarity | NPD7839 | Suspended |
0.6 | Remote Similarity | NPD7345 | Approved |
0.5981 | Remote Similarity | NPD2259 | Approved |
0.5981 | Remote Similarity | NPD2258 | Approved |
0.5978 | Remote Similarity | NPD3160 | Suspended |
0.5957 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.593 | Remote Similarity | NPD2263 | Discontinued |
0.5913 | Remote Similarity | NPD7505 | Discontinued |
0.5904 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.5895 | Remote Similarity | NPD5369 | Approved |
0.5872 | Remote Similarity | NPD4211 | Phase 1 |
0.5872 | Remote Similarity | NPD5357 | Phase 1 |
0.5843 | Remote Similarity | NPD3212 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD1407 | Approved |
0.5784 | Remote Similarity | NPD7983 | Approved |
0.5778 | Remote Similarity | NPD6944 | Clinical (unspecified phase) |
0.5776 | Remote Similarity | NPD6936 | Clinical (unspecified phase) |
0.5776 | Remote Similarity | NPD6935 | Phase 3 |
0.5773 | Remote Similarity | NPD7154 | Phase 3 |
0.575 | Remote Similarity | NPD4266 | Approved |
0.575 | Remote Similarity | NPD3194 | Approved |
0.575 | Remote Similarity | NPD3195 | Phase 2 |
0.575 | Remote Similarity | NPD3196 | Approved |
0.5745 | Remote Similarity | NPD4271 | Approved |
0.5745 | Remote Similarity | NPD4268 | Approved |
0.5743 | Remote Similarity | NPD6101 | Approved |
0.5743 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4738 | Phase 2 |
0.5702 | Remote Similarity | NPD8342 | Approved |
0.5702 | Remote Similarity | NPD8340 | Approved |
0.5702 | Remote Similarity | NPD8341 | Approved |
0.5702 | Remote Similarity | NPD8299 | Approved |
0.5699 | Remote Similarity | NPD2689 | Clinical (unspecified phase) |
0.5682 | Remote Similarity | NPD4247 | Clinical (unspecified phase) |
0.567 | Remote Similarity | NPD4270 | Approved |
0.567 | Remote Similarity | NPD4269 | Approved |
0.567 | Remote Similarity | NPD6435 | Approved |
0.5663 | Remote Similarity | NPD6109 | Phase 1 |
0.5658 | Remote Similarity | NPD3211 | Approved |
0.5656 | Remote Similarity | NPD8451 | Approved |
0.5656 | Remote Similarity | NPD4816 | Clinical (unspecified phase) |
0.5647 | Remote Similarity | NPD6949 | Clinical (unspecified phase) |
0.5631 | Remote Similarity | NPD6411 | Approved |
0.563 | Remote Similarity | NPD2217 | Approved |
0.563 | Remote Similarity | NPD2218 | Phase 2 |
0.5625 | Remote Similarity | NPD4822 | Approved |
0.5625 | Remote Similarity | NPD3172 | Approved |
0.5625 | Remote Similarity | NPD4821 | Approved |
0.5625 | Remote Similarity | NPD4820 | Approved |
0.5625 | Remote Similarity | NPD4252 | Approved |
0.5625 | Remote Similarity | NPD4819 | Approved |
0.5614 | Remote Similarity | NPD7116 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD8448 | Approved |
0.56 | Remote Similarity | NPD8390 | Approved |
0.56 | Remote Similarity | NPD5786 | Approved |
0.56 | Remote Similarity | NPD8391 | Approved |
0.56 | Remote Similarity | NPD8392 | Approved |
PubChem CID   | 44567586 |
ChEMBL   | CHEMBL465041 |
ZINC   |
Molecular Weight:   | 540.34 |
ALogP:   | -3.3866 |
MLogP:   | 3.44 |
XLogP:   | 6.02 |
# Rotatable Bonds:   | 21 |
Polar Surface Area:   | 158.24 |
# H-Bond Aceptor:   | 10 |
# H-Bond Donor:   | 4 |
# Rings:   | 1 |
# Heavy Atoms:   | 38 |