Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT314 | Organism | Bacillus cereus | Bacillus cereus | MIC | = | 17800 | nM | 15646539 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 17800 | nM | 15646539 |
NPT20 | Organism | Candida albicans | Candida albicans | MIC | = | 2500 | nM | 7714533 |
NPT312 | Organism | Saccharomyces cerevisiae | Saccharomyces cerevisiae | MIC | = | 2500 | nM | 15646539 |
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 NPC474985 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 |
---|---|---|
0.7748 | Intermediate Similarity | NPC474984 |
0.7411 | Intermediate Similarity | NPC474995 |
0.6757 | Remote Similarity | NPC474244 |
0.6697 | Remote Similarity | NPC52820 |
0.6667 | Remote Similarity | NPC474873 |
0.6609 | Remote Similarity | NPC474099 |
0.6581 | Remote Similarity | NPC58281 |
0.6549 | Remote Similarity | NPC199831 |
0.6549 | Remote Similarity | NPC474827 |
0.6549 | Remote Similarity | NPC68001 |
0.6549 | Remote Similarity | NPC474828 |
0.6518 | Remote Similarity | NPC188785 |
0.65 | Remote Similarity | NPC471768 |
0.6496 | Remote Similarity | NPC127578 |
0.6435 | Remote Similarity | NPC101106 |
0.6435 | Remote Similarity | NPC135216 |
0.641 | Remote Similarity | NPC474891 |
0.6379 | Remote Similarity | NPC250187 |
0.6355 | Remote Similarity | NPC81195 |
0.6333 | Remote Similarity | NPC475988 |
0.6325 | Remote Similarity | NPC287572 |
0.6325 | Remote Similarity | NPC474969 |
0.6325 | Remote Similarity | NPC476034 |
0.6325 | Remote Similarity | NPC471636 |
0.6294 | Remote Similarity | NPC475342 |
0.6281 | Remote Similarity | NPC472536 |
0.6281 | Remote Similarity | NPC103391 |
0.625 | Remote Similarity | NPC268327 |
0.625 | Remote Similarity | NPC295444 |
0.625 | Remote Similarity | NPC476344 |
0.625 | Remote Similarity | NPC273215 |
0.625 | Remote Similarity | NPC279383 |
0.6226 | Remote Similarity | NPC469861 |
0.6226 | Remote Similarity | NPC130436 |
0.6226 | Remote Similarity | NPC469860 |
0.6216 | Remote Similarity | NPC150041 |
0.6214 | Remote Similarity | NPC277341 |
0.6214 | Remote Similarity | NPC226982 |
0.6207 | Remote Similarity | NPC205176 |
0.6146 | Remote Similarity | NPC470256 |
0.614 | Remote Similarity | NPC26597 |
0.6107 | Remote Similarity | NPC41162 |
0.6102 | Remote Similarity | NPC271562 |
0.6082 | Remote Similarity | NPC151481 |
0.6068 | Remote Similarity | NPC469604 |
0.6042 | Remote Similarity | NPC194871 |
0.6038 | Remote Similarity | NPC475975 |
0.6033 | Remote Similarity | NPC59249 |
0.6 | Remote Similarity | NPC117746 |
0.6 | Remote Similarity | NPC159568 |
0.6 | Remote Similarity | NPC259599 |
0.6 | Remote Similarity | NPC294434 |
0.6 | Remote Similarity | NPC15499 |
0.6 | Remote Similarity | NPC470300 |
0.6 | Remote Similarity | NPC476355 |
0.5968 | Remote Similarity | NPC477554 |
0.5952 | Remote Similarity | NPC470788 |
0.595 | Remote Similarity | NPC469603 |
0.5932 | Remote Similarity | NPC133420 |
0.592 | Remote Similarity | NPC477553 |
0.5918 | Remote Similarity | NPC476591 |
0.5918 | Remote Similarity | NPC88877 |
0.5882 | Remote Similarity | NPC123360 |
0.5882 | Remote Similarity | NPC93179 |
0.5873 | Remote Similarity | NPC476155 |
0.5873 | Remote Similarity | NPC477555 |
0.5873 | Remote Similarity | NPC17581 |
0.5872 | Remote Similarity | NPC324506 |
0.5865 | Remote Similarity | NPC178277 |
0.5865 | Remote Similarity | NPC270126 |
0.5859 | Remote Similarity | NPC469660 |
0.5856 | Remote Similarity | NPC17143 |
0.5856 | Remote Similarity | NPC47230 |
0.5849 | Remote Similarity | NPC173609 |
0.5846 | Remote Similarity | NPC97580 |
0.5842 | Remote Similarity | NPC140287 |
0.5842 | Remote Similarity | NPC474758 |
0.5833 | Remote Similarity | NPC470688 |
0.5833 | Remote Similarity | NPC319913 |
0.5825 | Remote Similarity | NPC471225 |
0.5825 | Remote Similarity | NPC57744 |
0.5821 | Remote Similarity | NPC120335 |
0.5816 | Remote Similarity | NPC96272 |
0.5806 | Remote Similarity | NPC193471 |
0.5806 | Remote Similarity | NPC130124 |
0.5804 | Remote Similarity | NPC299808 |
0.5804 | Remote Similarity | NPC118844 |
0.5804 | Remote Similarity | NPC72183 |
0.5804 | Remote Similarity | NPC110875 |
0.5802 | Remote Similarity | NPC309525 |
0.58 | Remote Similarity | NPC163003 |
0.5798 | Remote Similarity | NPC44514 |
0.5798 | Remote Similarity | NPC64168 |
0.5781 | Remote Similarity | NPC230849 |
0.578 | Remote Similarity | NPC322672 |
0.5773 | Remote Similarity | NPC248125 |
0.5772 | Remote Similarity | NPC469455 |
0.5772 | Remote Similarity | NPC21713 |
0.5772 | Remote Similarity | NPC168758 |
0.5772 | Remote Similarity | NPC475608 |
0.5772 | Remote Similarity | NPC47857 |
0.5772 | Remote Similarity | NPC181510 |
0.5769 | Remote Similarity | NPC108816 |
0.5769 | Remote Similarity | NPC93763 |
0.5769 | Remote Similarity | NPC128276 |
0.5763 | Remote Similarity | NPC473289 |
0.5758 | Remote Similarity | NPC470693 |
0.5755 | Remote Similarity | NPC471325 |
0.5755 | Remote Similarity | NPC281949 |
0.5755 | Remote Similarity | NPC301477 |
0.5755 | Remote Similarity | NPC42470 |
0.5755 | Remote Similarity | NPC25684 |
0.5748 | Remote Similarity | NPC174463 |
0.5738 | Remote Similarity | NPC329305 |
0.5727 | Remote Similarity | NPC473525 |
0.5714 | Remote Similarity | NPC264227 |
0.5714 | Remote Similarity | NPC472266 |
0.5714 | Remote Similarity | NPC203335 |
0.5714 | Remote Similarity | NPC6271 |
0.5714 | Remote Similarity | NPC279833 |
0.5714 | Remote Similarity | NPC472965 |
0.5714 | Remote Similarity | NPC80439 |
0.5714 | Remote Similarity | NPC63649 |
0.5714 | Remote Similarity | NPC173690 |
0.5701 | Remote Similarity | NPC473810 |
0.569 | Remote Similarity | NPC241426 |
0.569 | Remote Similarity | NPC150967 |
0.5688 | Remote Similarity | NPC215364 |
0.5684 | Remote Similarity | NPC151648 |
0.5673 | Remote Similarity | NPC476794 |
0.5673 | Remote Similarity | NPC171204 |
0.5673 | Remote Similarity | NPC97516 |
0.5673 | Remote Similarity | NPC65603 |
0.5673 | Remote Similarity | NPC476028 |
0.5673 | Remote Similarity | NPC470240 |
0.5673 | Remote Similarity | NPC141789 |
0.5673 | Remote Similarity | NPC41780 |
0.5673 | Remote Similarity | NPC187568 |
0.5667 | Remote Similarity | NPC476921 |
0.5667 | Remote Similarity | NPC75523 |
0.566 | Remote Similarity | NPC281132 |
0.5657 | Remote Similarity | NPC276290 |
0.5656 | Remote Similarity | NPC470072 |
0.5656 | Remote Similarity | NPC171734 |
0.5648 | Remote Similarity | NPC16488 |
0.5648 | Remote Similarity | NPC318468 |
0.5645 | Remote Similarity | NPC476875 |
0.5644 | Remote Similarity | NPC316185 |
0.5636 | Remote Similarity | NPC107787 |
0.5631 | Remote Similarity | NPC329852 |
0.5631 | Remote Similarity | NPC138408 |
0.5631 | Remote Similarity | NPC226669 |
0.5631 | Remote Similarity | NPC193351 |
0.5631 | Remote Similarity | NPC155587 |
0.5625 | Remote Similarity | NPC179087 |
0.5625 | Remote Similarity | NPC235625 |
0.5625 | Remote Similarity | NPC106791 |
0.5625 | Remote Similarity | NPC210303 |
0.5625 | Remote Similarity | NPC284656 |
0.5625 | Remote Similarity | NPC474658 |
0.5625 | Remote Similarity | NPC201889 |
0.5625 | Remote Similarity | NPC44343 |
0.5625 | Remote Similarity | NPC217940 |
0.5619 | Remote Similarity | NPC267231 |
0.561 | Remote Similarity | NPC21324 |
0.5607 | Remote Similarity | NPC112868 |
0.5607 | Remote Similarity | NPC141810 |
0.5607 | Remote Similarity | NPC325031 |
0.56 | Remote Similarity | NPC265574 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC474985 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 |
---|---|---|---|
0.6579 | Remote Similarity | NPD777 | Phase 3 |
0.6435 | Remote Similarity | NPD4211 | Phase 1 |
0.621 | Remote Similarity | NPD2495 | Phase 3 |
0.621 | Remote Similarity | NPD3159 | Discontinued |
0.6129 | Remote Similarity | NPD1773 | Discontinued |
0.6102 | Remote Similarity | NPD2147 | Approved |
0.61 | Remote Similarity | NPD1452 | Discontinued |
0.6047 | Remote Similarity | NPD3677 | Clinical (unspecified phase) |
0.6032 | Remote Similarity | NPD2645 | Approved |
0.6 | Remote Similarity | NPD2099 | Approved |
0.5887 | Remote Similarity | NPD2100 | Approved |
0.5854 | Remote Similarity | NPD2090 | Approved |
0.5814 | Remote Similarity | NPD1806 | Approved |
0.5814 | Remote Similarity | NPD1748 | Approved |
0.5804 | Remote Similarity | NPD161 | Discontinued |
0.5739 | Remote Similarity | NPD4228 | Discovery |
0.5738 | Remote Similarity | NPD6413 | Approved |
0.5728 | Remote Similarity | NPD1115 | Approved |
0.5728 | Remote Similarity | NPD1114 | Approved |
0.5703 | Remote Similarity | NPD4708 | Discontinued |
0.5682 | Remote Similarity | NPD2148 | Clinical (unspecified phase) |
0.568 | Remote Similarity | NPD1376 | Discontinued |
0.5659 | Remote Similarity | NPD806 | Approved |
0.5659 | Remote Similarity | NPD805 | Approved |
PubChem CID   | 11611475 |
ChEMBL   | CHEMBL491169 |
ZINC   |
Molecular Weight:   | 419.18 |
ALogP:   | 2.1208 |
MLogP:   | 3.11 |
XLogP:   | 3.691 |
# Rotatable Bonds:   | 8 |
Polar Surface Area:   | 106.05 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 29 |