Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | > | 128 | ug/ml | PubChem BioAssay data set |
NPT79 | Organism | Bacillus subtilis | Bacillus subtilis | MIC | > | 128 | ug/ml | PubChem BioAssay data set |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | > | 128 | ug/ml | 21902175 |
NPT1531 | Organism | Enterococcus faecium | Enterococcus faecium | MIC | > | 128 | ug/ml | 19715320 |
NPT19 | Organism | Escherichia coli | Escherichia coli | MIC | > | 128 | ug/ml | 19715320 |
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 NPC70996 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 |
---|---|---|
0.875 | High Similarity | NPC475062 |
0.8642 | High Similarity | NPC470657 |
0.8537 | High Similarity | NPC31349 |
0.8442 | Intermediate Similarity | NPC214030 |
0.8442 | Intermediate Similarity | NPC83108 |
0.8243 | Intermediate Similarity | NPC98711 |
0.8214 | Intermediate Similarity | NPC470009 |
0.7821 | Intermediate Similarity | NPC215030 |
0.7692 | Intermediate Similarity | NPC58267 |
0.7692 | Intermediate Similarity | NPC263674 |
0.7692 | Intermediate Similarity | NPC261372 |
0.7667 | Intermediate Similarity | NPC215570 |
0.7632 | Intermediate Similarity | NPC319007 |
0.7619 | Intermediate Similarity | NPC474266 |
0.7595 | Intermediate Similarity | NPC477867 |
0.7528 | Intermediate Similarity | NPC474065 |
0.75 | Intermediate Similarity | NPC475849 |
0.7474 | Intermediate Similarity | NPC475928 |
0.7468 | Intermediate Similarity | NPC470659 |
0.7468 | Intermediate Similarity | NPC470660 |
0.7447 | Intermediate Similarity | NPC3488 |
0.7447 | Intermediate Similarity | NPC287539 |
0.7444 | Intermediate Similarity | NPC161035 |
0.7412 | Intermediate Similarity | NPC111409 |
0.7412 | Intermediate Similarity | NPC157328 |
0.7407 | Intermediate Similarity | NPC279575 |
0.7391 | Intermediate Similarity | NPC193785 |
0.7391 | Intermediate Similarity | NPC474297 |
0.7386 | Intermediate Similarity | NPC33398 |
0.7381 | Intermediate Similarity | NPC216941 |
0.7368 | Intermediate Similarity | NPC473899 |
0.7368 | Intermediate Similarity | NPC35185 |
0.7368 | Intermediate Similarity | NPC177013 |
0.7368 | Intermediate Similarity | NPC474730 |
0.7368 | Intermediate Similarity | NPC4899 |
0.7342 | Intermediate Similarity | NPC184550 |
0.7342 | Intermediate Similarity | NPC185419 |
0.7333 | Intermediate Similarity | NPC235051 |
0.732 | Intermediate Similarity | NPC170432 |
0.732 | Intermediate Similarity | NPC127235 |
0.7312 | Intermediate Similarity | NPC471241 |
0.7312 | Intermediate Similarity | NPC328180 |
0.7312 | Intermediate Similarity | NPC278028 |
0.7312 | Intermediate Similarity | NPC236580 |
0.7312 | Intermediate Similarity | NPC304445 |
0.7312 | Intermediate Similarity | NPC472273 |
0.7294 | Intermediate Similarity | NPC212340 |
0.7292 | Intermediate Similarity | NPC37240 |
0.7273 | Intermediate Similarity | NPC475773 |
0.7263 | Intermediate Similarity | NPC478181 |
0.7263 | Intermediate Similarity | NPC67296 |
0.7262 | Intermediate Similarity | NPC60568 |
0.725 | Intermediate Similarity | NPC291228 |
0.725 | Intermediate Similarity | NPC248427 |
0.725 | Intermediate Similarity | NPC308096 |
0.7245 | Intermediate Similarity | NPC148270 |
0.7245 | Intermediate Similarity | NPC197813 |
0.7245 | Intermediate Similarity | NPC80338 |
0.7234 | Intermediate Similarity | NPC37866 |
0.7222 | Intermediate Similarity | NPC246173 |
0.7222 | Intermediate Similarity | NPC77756 |
0.7216 | Intermediate Similarity | NPC88469 |
0.72 | Intermediate Similarity | NPC325773 |
0.7188 | Intermediate Similarity | NPC106668 |
0.7188 | Intermediate Similarity | NPC292803 |
0.7172 | Intermediate Similarity | NPC110701 |
0.7158 | Intermediate Similarity | NPC20028 |
0.7143 | Intermediate Similarity | NPC170595 |
0.7143 | Intermediate Similarity | NPC475878 |
0.7128 | Intermediate Similarity | NPC472290 |
0.7126 | Intermediate Similarity | NPC101138 |
0.7126 | Intermediate Similarity | NPC25802 |
0.7126 | Intermediate Similarity | NPC51135 |
0.7126 | Intermediate Similarity | NPC82492 |
0.7126 | Intermediate Similarity | NPC291310 |
0.7113 | Intermediate Similarity | NPC27687 |
0.7113 | Intermediate Similarity | NPC107385 |
0.7111 | Intermediate Similarity | NPC200580 |
0.7108 | Intermediate Similarity | NPC474003 |
0.7097 | Intermediate Similarity | NPC305808 |
0.7089 | Intermediate Similarity | NPC28526 |
0.7079 | Intermediate Similarity | NPC239938 |
0.7073 | Intermediate Similarity | NPC179922 |
0.7065 | Intermediate Similarity | NPC472238 |
0.7065 | Intermediate Similarity | NPC472237 |
0.7065 | Intermediate Similarity | NPC476189 |
0.7059 | Intermediate Similarity | NPC156658 |
0.7059 | Intermediate Similarity | NPC258965 |
0.7053 | Intermediate Similarity | NPC249171 |
0.7053 | Intermediate Similarity | NPC49833 |
0.7051 | Intermediate Similarity | NPC206601 |
0.7045 | Intermediate Similarity | NPC473350 |
0.7045 | Intermediate Similarity | NPC478111 |
0.7041 | Intermediate Similarity | NPC114365 |
0.7041 | Intermediate Similarity | NPC18044 |
0.7041 | Intermediate Similarity | NPC18433 |
0.7041 | Intermediate Similarity | NPC132304 |
0.7041 | Intermediate Similarity | NPC123070 |
0.7041 | Intermediate Similarity | NPC88890 |
0.7041 | Intermediate Similarity | NPC177518 |
0.7041 | Intermediate Similarity | NPC154962 |
0.7041 | Intermediate Similarity | NPC169089 |
0.7041 | Intermediate Similarity | NPC470167 |
0.703 | Intermediate Similarity | NPC193741 |
0.7024 | Intermediate Similarity | NPC470014 |
0.7011 | Intermediate Similarity | NPC128246 |
0.701 | Intermediate Similarity | NPC310031 |
0.701 | Intermediate Similarity | NPC80144 |
0.701 | Intermediate Similarity | NPC470172 |
0.701 | Intermediate Similarity | NPC80191 |
0.701 | Intermediate Similarity | NPC213528 |
0.701 | Intermediate Similarity | NPC244969 |
0.7 | Intermediate Similarity | NPC203170 |
0.6989 | Remote Similarity | NPC63897 |
0.6989 | Remote Similarity | NPC470424 |
0.6989 | Remote Similarity | NPC470423 |
0.6979 | Remote Similarity | NPC41843 |
0.6979 | Remote Similarity | NPC473146 |
0.6977 | Remote Similarity | NPC126248 |
0.6977 | Remote Similarity | NPC30443 |
0.6977 | Remote Similarity | NPC45256 |
0.6977 | Remote Similarity | NPC285480 |
0.6977 | Remote Similarity | NPC260977 |
0.697 | Remote Similarity | NPC215408 |
0.6961 | Remote Similarity | NPC469824 |
0.6957 | Remote Similarity | NPC52756 |
0.6939 | Remote Similarity | NPC473406 |
0.6939 | Remote Similarity | NPC471253 |
0.6939 | Remote Similarity | NPC473148 |
0.6932 | Remote Similarity | NPC473791 |
0.6923 | Remote Similarity | NPC215556 |
0.6915 | Remote Similarity | NPC93869 |
0.6915 | Remote Similarity | NPC6765 |
0.6907 | Remote Similarity | NPC477172 |
0.6905 | Remote Similarity | NPC188793 |
0.69 | Remote Similarity | NPC203974 |
0.69 | Remote Similarity | NPC176756 |
0.6897 | Remote Similarity | NPC24556 |
0.6893 | Remote Similarity | NPC475851 |
0.6893 | Remote Similarity | NPC475924 |
0.6893 | Remote Similarity | NPC477489 |
0.6889 | Remote Similarity | NPC314364 |
0.6882 | Remote Similarity | NPC472232 |
0.6882 | Remote Similarity | NPC472231 |
0.6875 | Remote Similarity | NPC241265 |
0.6875 | Remote Similarity | NPC285003 |
0.6875 | Remote Similarity | NPC211087 |
0.6875 | Remote Similarity | NPC253995 |
0.6869 | Remote Similarity | NPC100078 |
0.6867 | Remote Similarity | NPC155441 |
0.6863 | Remote Similarity | NPC114961 |
0.6863 | Remote Similarity | NPC27551 |
0.6863 | Remote Similarity | NPC98633 |
0.6848 | Remote Similarity | NPC216284 |
0.6842 | Remote Similarity | NPC475785 |
0.6842 | Remote Similarity | NPC476728 |
0.6842 | Remote Similarity | NPC161293 |
0.6842 | Remote Similarity | NPC475765 |
0.6837 | Remote Similarity | NPC304163 |
0.6837 | Remote Similarity | NPC94919 |
0.6835 | Remote Similarity | NPC286842 |
0.6832 | Remote Similarity | NPC167044 |
0.6832 | Remote Similarity | NPC92890 |
0.6832 | Remote Similarity | NPC202898 |
0.6832 | Remote Similarity | NPC472079 |
0.6832 | Remote Similarity | NPC475319 |
0.6818 | Remote Similarity | NPC15091 |
0.6813 | Remote Similarity | NPC191221 |
0.6813 | Remote Similarity | NPC79549 |
0.6809 | Remote Similarity | NPC274588 |
0.68 | Remote Similarity | NPC103172 |
0.68 | Remote Similarity | NPC166079 |
0.68 | Remote Similarity | NPC164600 |
0.68 | Remote Similarity | NPC306776 |
0.68 | Remote Similarity | NPC285927 |
0.6796 | Remote Similarity | NPC471251 |
0.6782 | Remote Similarity | NPC475743 |
0.6778 | Remote Similarity | NPC472272 |
0.6768 | Remote Similarity | NPC34562 |
0.6765 | Remote Similarity | NPC273002 |
0.6765 | Remote Similarity | NPC236753 |
0.6765 | Remote Similarity | NPC471250 |
0.6765 | Remote Similarity | NPC227879 |
0.6765 | Remote Similarity | NPC94086 |
0.6765 | Remote Similarity | NPC217041 |
0.6765 | Remote Similarity | NPC233433 |
0.6765 | Remote Similarity | NPC208333 |
0.6765 | Remote Similarity | NPC473817 |
0.6765 | Remote Similarity | NPC228190 |
0.6765 | Remote Similarity | NPC92297 |
0.6765 | Remote Similarity | NPC220836 |
0.6762 | Remote Similarity | NPC79193 |
0.675 | Remote Similarity | NPC97736 |
0.675 | Remote Similarity | NPC82315 |
0.675 | Remote Similarity | NPC50228 |
0.6744 | Remote Similarity | NPC22742 |
0.6744 | Remote Similarity | NPC294748 |
0.6744 | Remote Similarity | NPC477344 |
0.6744 | Remote Similarity | NPC472310 |
0.6744 | Remote Similarity | NPC80891 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC70996 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 |
---|---|---|---|
0.7875 | Intermediate Similarity | NPD4802 | Phase 2 |
0.7875 | Intermediate Similarity | NPD4238 | Approved |
0.726 | Intermediate Similarity | NPD3198 | Approved |
0.7073 | Intermediate Similarity | NPD3702 | Approved |
0.7041 | Intermediate Similarity | NPD4057 | Clinical (unspecified phase) |
0.7041 | Intermediate Similarity | NPD4056 | Clinical (unspecified phase) |
0.6977 | Remote Similarity | NPD1779 | Approved |
0.6977 | Remote Similarity | NPD1780 | Approved |
0.6869 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.6629 | Remote Similarity | NPD3670 | Clinical (unspecified phase) |
0.6629 | Remote Similarity | NPD3669 | Approved |
0.6628 | Remote Similarity | NPD6114 | Approved |
0.6628 | Remote Similarity | NPD6115 | Approved |
0.6628 | Remote Similarity | NPD6697 | Approved |
0.6628 | Remote Similarity | NPD6118 | Approved |
0.6517 | Remote Similarity | NPD6435 | Approved |
0.6512 | Remote Similarity | NPD6116 | Phase 1 |
0.6477 | Remote Similarity | NPD6928 | Phase 2 |
0.6456 | Remote Similarity | NPD7909 | Approved |
0.642 | Remote Similarity | NPD897 | Approved |
0.642 | Remote Similarity | NPD896 | Approved |
0.642 | Remote Similarity | NPD898 | Approved |
0.6408 | Remote Similarity | NPD6412 | Phase 2 |
0.64 | Remote Similarity | NPD1700 | Approved |
0.6395 | Remote Similarity | NPD6117 | Approved |
0.6353 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
0.6337 | Remote Similarity | NPD8083 | Approved |
0.6337 | Remote Similarity | NPD8084 | Approved |
0.6337 | Remote Similarity | NPD8138 | Approved |
0.6337 | Remote Similarity | NPD8086 | Approved |
0.6337 | Remote Similarity | NPD8139 | Approved |
0.6337 | Remote Similarity | NPD8085 | Approved |
0.6337 | Remote Similarity | NPD8082 | Approved |
0.631 | Remote Similarity | NPD5777 | Approved |
0.6292 | Remote Similarity | NPD5368 | Approved |
0.6275 | Remote Similarity | NPD8275 | Approved |
0.6275 | Remote Similarity | NPD8276 | Approved |
0.6265 | Remote Similarity | NPD3698 | Phase 2 |
0.6222 | Remote Similarity | NPD5369 | Approved |
0.6214 | Remote Similarity | NPD8081 | Approved |
0.6204 | Remote Similarity | NPD8133 | Approved |
0.619 | Remote Similarity | NPD4245 | Approved |
0.619 | Remote Similarity | NPD4244 | Approved |
0.6186 | Remote Similarity | NPD8171 | Discontinued |
0.6173 | Remote Similarity | NPD3171 | Clinical (unspecified phase) |
0.6163 | Remote Similarity | NPD1810 | Approved |
0.6163 | Remote Similarity | NPD1811 | Approved |
0.6154 | Remote Similarity | NPD8393 | Approved |
0.6133 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.6133 | Remote Similarity | NPD615 | Clinical (unspecified phase) |
0.6092 | Remote Similarity | NPD2257 | Approved |
0.6092 | Remote Similarity | NPD3703 | Phase 2 |
0.6091 | Remote Similarity | NPD6940 | Discontinued |
0.6087 | Remote Similarity | NPD5362 | Discontinued |
0.6064 | Remote Similarity | NPD4249 | Approved |
0.6064 | Remote Similarity | NPD5786 | Approved |
0.6038 | Remote Similarity | NPD6686 | Approved |
0.6034 | Remote Similarity | NPD7507 | Approved |
0.6 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD4250 | Approved |
0.6 | Remote Similarity | NPD4251 | Approved |
0.5981 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.5978 | Remote Similarity | NPD4269 | Approved |
0.5978 | Remote Similarity | NPD4270 | Approved |
0.5957 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5943 | Remote Similarity | NPD8140 | Approved |
0.5943 | Remote Similarity | NPD8307 | Discontinued |
0.5934 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.593 | Remote Similarity | NPD4808 | Clinical (unspecified phase) |
0.593 | Remote Similarity | NPD6081 | Approved |
0.593 | Remote Similarity | NPD4809 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD8961 | Approved |
0.5918 | Remote Similarity | NPD8034 | Phase 2 |
0.5918 | Remote Similarity | NPD8035 | Phase 2 |
0.5915 | Remote Similarity | NPD634 | Phase 3 |
0.5904 | Remote Similarity | NPD4224 | Phase 2 |
0.5893 | Remote Similarity | NPD6009 | Approved |
0.5882 | Remote Similarity | NPD7319 | Approved |
0.5882 | Remote Similarity | NPD3700 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD3699 | Clinical (unspecified phase) |
0.5859 | Remote Similarity | NPD6399 | Phase 3 |
0.5847 | Remote Similarity | NPD8293 | Discontinued |
0.5833 | Remote Similarity | NPD8306 | Approved |
0.5833 | Remote Similarity | NPD8305 | Approved |
0.5824 | Remote Similarity | NPD7329 | Approved |
0.5818 | Remote Similarity | NPD6882 | Approved |
0.5818 | Remote Similarity | NPD6053 | Discontinued |
0.5814 | Remote Similarity | NPD4789 | Approved |
0.5798 | Remote Similarity | NPD7736 | Approved |
0.5789 | Remote Similarity | NPD5363 | Approved |
0.5783 | Remote Similarity | NPD9496 | Clinical (unspecified phase) |
0.578 | Remote Similarity | NPD8087 | Discontinued |
0.5776 | Remote Similarity | NPD6370 | Approved |
0.5765 | Remote Similarity | NPD229 | Approved |
0.5761 | Remote Similarity | NPD4821 | Approved |
0.5761 | Remote Similarity | NPD4820 | Approved |
0.5761 | Remote Similarity | NPD4822 | Approved |
0.5761 | Remote Similarity | NPD4819 | Approved |
0.5761 | Remote Similarity | NPD4252 | Approved |
0.5752 | Remote Similarity | NPD8295 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4271 | Approved |
0.5714 | Remote Similarity | NPD1695 | Approved |
0.5714 | Remote Similarity | NPD4268 | Approved |
0.5714 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD3728 | Approved |
0.5714 | Remote Similarity | NPD3730 | Approved |
0.5701 | Remote Similarity | NPD6402 | Approved |
0.5701 | Remote Similarity | NPD6008 | Approved |
0.5701 | Remote Similarity | NPD7128 | Approved |
0.5701 | Remote Similarity | NPD6675 | Approved |
0.5701 | Remote Similarity | NPD5739 | Approved |
0.5688 | Remote Similarity | NPD6373 | Approved |
0.5688 | Remote Similarity | NPD6372 | Approved |
0.5682 | Remote Similarity | NPD3181 | Approved |
0.5678 | Remote Similarity | NPD7492 | Approved |
0.5657 | Remote Similarity | NPD6698 | Approved |
0.5657 | Remote Similarity | NPD5785 | Approved |
0.5657 | Remote Similarity | NPD46 | Approved |
0.5648 | Remote Similarity | NPD5697 | Approved |
0.5648 | Remote Similarity | NPD5701 | Approved |
0.5638 | Remote Similarity | NPD7345 | Approved |
0.5632 | Remote Similarity | NPD2687 | Approved |
0.5632 | Remote Similarity | NPD2254 | Approved |
0.5632 | Remote Similarity | NPD2686 | Approved |
0.5631 | Remote Similarity | NPD6083 | Phase 2 |
0.5631 | Remote Similarity | NPD6084 | Phase 2 |
0.563 | Remote Similarity | NPD6616 | Approved |
0.5625 | Remote Similarity | NPD4632 | Approved |
0.5625 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5614 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5603 | Remote Similarity | NPD6054 | Approved |
0.5603 | Remote Similarity | NPD6059 | Approved |
PubChem CID   | 3009696 |
ChEMBL   | CHEMBL495270 |
ZINC   |
Molecular Weight:   | 230.12 |
ALogP:   | -1.338 |
MLogP:   | 2.12 |
XLogP:   | -0.399 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 75.99 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 2 |
# Rings:   | 2 |
# Heavy Atoms:   | 16 |