Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO25695 | Oplopanax horridus | Species | Araliaceae | Eukaryota |
PMID[9392889] |
|||
NPO23922 | Helichrysum oxyphyllum | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO25131 | Parmelia weberi | Species | Parmeliaceae | Eukaryota | UNPD* | |||
NPO25663 | Piscidia piscipula | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO23679 | Streptomyces roseiscleroticus | Species | Streptomycetaceae | Bacteria | UNPD* | |||
NPO24374 | Brunsvigia orientalis | Species | Amaryllidaceae | Eukaryota | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT19 | Organism | Escherichia coli | Escherichia coli | MIC | > | 50 | ug/ml | 9392889 |
NPT18 | Organism | Pseudomonas aeruginosa | Pseudomonas aeruginosa | MIC | > | 50 | ug/ml | 9392889 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | > | 50 | ug/ml | 9392889 |
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 50 | ug/ml | 9392889 |
NPT79 | Organism | Bacillus subtilis | Bacillus subtilis | MIC | = | 25 | ug/ml | 9392889 |
NPT20 | Organism | Candida albicans | Candida albicans | MIC | > | 50 | ug/ml | 9392889 |
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 NPC29697 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 |
---|---|---|
0.9828 | High Similarity | NPC325929 |
0.9828 | High Similarity | NPC66460 |
0.9828 | High Similarity | NPC271282 |
0.9167 | High Similarity | NPC475984 |
0.9016 | High Similarity | NPC470965 |
0.8833 | High Similarity | NPC474267 |
0.8621 | High Similarity | NPC49059 |
0.8621 | High Similarity | NPC256209 |
0.8571 | High Similarity | NPC470320 |
0.8571 | High Similarity | NPC226592 |
0.85 | High Similarity | NPC212730 |
0.85 | High Similarity | NPC44542 |
0.85 | High Similarity | NPC265551 |
0.85 | High Similarity | NPC472445 |
0.8387 | Intermediate Similarity | NPC471278 |
0.8361 | Intermediate Similarity | NPC469373 |
0.8226 | Intermediate Similarity | NPC222852 |
0.8209 | Intermediate Similarity | NPC470436 |
0.8197 | Intermediate Similarity | NPC48968 |
0.8197 | Intermediate Similarity | NPC594 |
0.8197 | Intermediate Similarity | NPC470970 |
0.8167 | Intermediate Similarity | NPC474513 |
0.8167 | Intermediate Similarity | NPC477726 |
0.8167 | Intermediate Similarity | NPC477725 |
0.8167 | Intermediate Similarity | NPC146551 |
0.8167 | Intermediate Similarity | NPC470963 |
0.8103 | Intermediate Similarity | NPC129263 |
0.8103 | Intermediate Similarity | NPC151782 |
0.8095 | Intermediate Similarity | NPC299730 |
0.8033 | Intermediate Similarity | NPC470964 |
0.8033 | Intermediate Similarity | NPC470968 |
0.8033 | Intermediate Similarity | NPC311648 |
0.8033 | Intermediate Similarity | NPC471960 |
0.8033 | Intermediate Similarity | NPC477661 |
0.8033 | Intermediate Similarity | NPC470969 |
0.8033 | Intermediate Similarity | NPC473847 |
0.8033 | Intermediate Similarity | NPC475384 |
0.8033 | Intermediate Similarity | NPC470966 |
0.8033 | Intermediate Similarity | NPC161838 |
0.8033 | Intermediate Similarity | NPC470967 |
0.8 | Intermediate Similarity | NPC110732 |
0.7969 | Intermediate Similarity | NPC113293 |
0.7969 | Intermediate Similarity | NPC477829 |
0.7969 | Intermediate Similarity | NPC26810 |
0.7931 | Intermediate Similarity | NPC72699 |
0.791 | Intermediate Similarity | NPC26500 |
0.791 | Intermediate Similarity | NPC99619 |
0.7903 | Intermediate Similarity | NPC471277 |
0.7903 | Intermediate Similarity | NPC193975 |
0.7903 | Intermediate Similarity | NPC471279 |
0.7879 | Intermediate Similarity | NPC136164 |
0.7879 | Intermediate Similarity | NPC245947 |
0.7879 | Intermediate Similarity | NPC255863 |
0.7869 | Intermediate Similarity | NPC473725 |
0.7869 | Intermediate Similarity | NPC475353 |
0.7869 | Intermediate Similarity | NPC473910 |
0.7869 | Intermediate Similarity | NPC152668 |
0.7869 | Intermediate Similarity | NPC473721 |
0.7869 | Intermediate Similarity | NPC52264 |
0.7869 | Intermediate Similarity | NPC473896 |
0.7869 | Intermediate Similarity | NPC473735 |
0.7857 | Intermediate Similarity | NPC470435 |
0.7857 | Intermediate Similarity | NPC329890 |
0.7833 | Intermediate Similarity | NPC34577 |
0.7826 | Intermediate Similarity | NPC4299 |
0.7812 | Intermediate Similarity | NPC327112 |
0.7759 | Intermediate Similarity | NPC153538 |
0.7759 | Intermediate Similarity | NPC248884 |
0.7759 | Intermediate Similarity | NPC207815 |
0.7759 | Intermediate Similarity | NPC85079 |
0.7759 | Intermediate Similarity | NPC31194 |
0.7705 | Intermediate Similarity | NPC473532 |
0.7705 | Intermediate Similarity | NPC137538 |
0.7692 | Intermediate Similarity | NPC328776 |
0.7692 | Intermediate Similarity | NPC321838 |
0.7692 | Intermediate Similarity | NPC320305 |
0.7692 | Intermediate Similarity | NPC201939 |
0.7681 | Intermediate Similarity | NPC143396 |
0.7681 | Intermediate Similarity | NPC101622 |
0.7667 | Intermediate Similarity | NPC142092 |
0.7647 | Intermediate Similarity | NPC22101 |
0.7647 | Intermediate Similarity | NPC330426 |
0.7647 | Intermediate Similarity | NPC473752 |
0.7647 | Intermediate Similarity | NPC148192 |
0.7647 | Intermediate Similarity | NPC127091 |
0.7647 | Intermediate Similarity | NPC104537 |
0.7647 | Intermediate Similarity | NPC271921 |
0.7647 | Intermediate Similarity | NPC25298 |
0.7612 | Intermediate Similarity | NPC326268 |
0.7612 | Intermediate Similarity | NPC318420 |
0.7606 | Intermediate Similarity | NPC329914 |
0.7606 | Intermediate Similarity | NPC477085 |
0.7606 | Intermediate Similarity | NPC327383 |
0.7606 | Intermediate Similarity | NPC185186 |
0.7581 | Intermediate Similarity | NPC474913 |
0.7571 | Intermediate Similarity | NPC476037 |
0.7541 | Intermediate Similarity | NPC477724 |
0.7541 | Intermediate Similarity | NPC187361 |
0.7541 | Intermediate Similarity | NPC26102 |
0.7538 | Intermediate Similarity | NPC328311 |
0.7538 | Intermediate Similarity | NPC243532 |
0.7536 | Intermediate Similarity | NPC473559 |
0.7536 | Intermediate Similarity | NPC141481 |
0.7536 | Intermediate Similarity | NPC324981 |
0.7536 | Intermediate Similarity | NPC48218 |
0.7534 | Intermediate Similarity | NPC188860 |
0.75 | Intermediate Similarity | NPC93639 |
0.75 | Intermediate Similarity | NPC71053 |
0.75 | Intermediate Similarity | NPC55383 |
0.75 | Intermediate Similarity | NPC59408 |
0.75 | Intermediate Similarity | NPC146811 |
0.7465 | Intermediate Similarity | NPC477086 |
0.7465 | Intermediate Similarity | NPC477087 |
0.7463 | Intermediate Similarity | NPC68343 |
0.7463 | Intermediate Similarity | NPC328089 |
0.746 | Intermediate Similarity | NPC472808 |
0.746 | Intermediate Similarity | NPC179764 |
0.746 | Intermediate Similarity | NPC187777 |
0.746 | Intermediate Similarity | NPC324224 |
0.7458 | Intermediate Similarity | NPC471280 |
0.7458 | Intermediate Similarity | NPC471275 |
0.7458 | Intermediate Similarity | NPC471276 |
0.7458 | Intermediate Similarity | NPC125122 |
0.7432 | Intermediate Similarity | NPC233071 |
0.7429 | Intermediate Similarity | NPC236208 |
0.7429 | Intermediate Similarity | NPC130618 |
0.7429 | Intermediate Similarity | NPC475004 |
0.7424 | Intermediate Similarity | NPC55376 |
0.7419 | Intermediate Similarity | NPC269615 |
0.7419 | Intermediate Similarity | NPC48058 |
0.7414 | Intermediate Similarity | NPC35141 |
0.7414 | Intermediate Similarity | NPC55063 |
0.7414 | Intermediate Similarity | NPC19834 |
0.7414 | Intermediate Similarity | NPC124183 |
0.7397 | Intermediate Similarity | NPC260396 |
0.7397 | Intermediate Similarity | NPC327041 |
0.7397 | Intermediate Similarity | NPC285840 |
0.7391 | Intermediate Similarity | NPC473829 |
0.7391 | Intermediate Similarity | NPC478097 |
0.7391 | Intermediate Similarity | NPC475443 |
0.7385 | Intermediate Similarity | NPC318306 |
0.7353 | Intermediate Similarity | NPC476655 |
0.7353 | Intermediate Similarity | NPC478098 |
0.7353 | Intermediate Similarity | NPC478099 |
0.7353 | Intermediate Similarity | NPC476654 |
0.7353 | Intermediate Similarity | NPC19769 |
0.7353 | Intermediate Similarity | NPC96414 |
0.7353 | Intermediate Similarity | NPC476657 |
0.7344 | Intermediate Similarity | NPC474577 |
0.7333 | Intermediate Similarity | NPC473913 |
0.7333 | Intermediate Similarity | NPC328784 |
0.7333 | Intermediate Similarity | NPC477727 |
0.7333 | Intermediate Similarity | NPC199286 |
0.7333 | Intermediate Similarity | NPC248775 |
0.7333 | Intermediate Similarity | NPC474642 |
0.7333 | Intermediate Similarity | NPC471281 |
0.7333 | Intermediate Similarity | NPC249670 |
0.7333 | Intermediate Similarity | NPC291437 |
0.7324 | Intermediate Similarity | NPC476660 |
0.7324 | Intermediate Similarity | NPC476012 |
0.7324 | Intermediate Similarity | NPC42526 |
0.7302 | Intermediate Similarity | NPC473863 |
0.7302 | Intermediate Similarity | NPC274290 |
0.7302 | Intermediate Similarity | NPC471239 |
0.7302 | Intermediate Similarity | NPC317899 |
0.7302 | Intermediate Similarity | NPC54766 |
0.7286 | Intermediate Similarity | NPC474823 |
0.7273 | Intermediate Similarity | NPC81896 |
0.7273 | Intermediate Similarity | NPC321919 |
0.726 | Intermediate Similarity | NPC227396 |
0.7258 | Intermediate Similarity | NPC474496 |
0.7246 | Intermediate Similarity | NPC476659 |
0.7246 | Intermediate Similarity | NPC476656 |
0.7246 | Intermediate Similarity | NPC201356 |
0.7241 | Intermediate Similarity | NPC269074 |
0.7237 | Intermediate Similarity | NPC470148 |
0.7237 | Intermediate Similarity | NPC55304 |
0.7237 | Intermediate Similarity | NPC180725 |
0.7237 | Intermediate Similarity | NPC1180 |
0.7237 | Intermediate Similarity | NPC226226 |
0.7237 | Intermediate Similarity | NPC470149 |
0.7222 | Intermediate Similarity | NPC472254 |
0.7213 | Intermediate Similarity | NPC294278 |
0.7213 | Intermediate Similarity | NPC474495 |
0.7213 | Intermediate Similarity | NPC170776 |
0.7213 | Intermediate Similarity | NPC9273 |
0.7213 | Intermediate Similarity | NPC76198 |
0.7213 | Intermediate Similarity | NPC165447 |
0.7213 | Intermediate Similarity | NPC197272 |
0.7213 | Intermediate Similarity | NPC475477 |
0.7213 | Intermediate Similarity | NPC471959 |
0.7213 | Intermediate Similarity | NPC329608 |
0.7213 | Intermediate Similarity | NPC89824 |
0.7213 | Intermediate Similarity | NPC473672 |
0.7213 | Intermediate Similarity | NPC256656 |
0.7213 | Intermediate Similarity | NPC224148 |
0.7213 | Intermediate Similarity | NPC477723 |
0.7206 | Intermediate Similarity | NPC476658 |
0.72 | Intermediate Similarity | NPC474026 |
0.72 | Intermediate Similarity | NPC40049 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC29697 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 |
---|---|---|---|
0.7812 | Intermediate Similarity | NPD4246 | Clinical (unspecified phase) |
0.7206 | Intermediate Similarity | NPD3197 | Phase 1 |
0.7143 | Intermediate Similarity | NPD4247 | Clinical (unspecified phase) |
0.7143 | Intermediate Similarity | NPD5790 | Clinical (unspecified phase) |
0.7089 | Intermediate Similarity | NPD5331 | Approved |
0.7089 | Intermediate Similarity | NPD5332 | Approved |
0.6984 | Remote Similarity | NPD3172 | Approved |
0.6914 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.6883 | Remote Similarity | NPD4268 | Approved |
0.6883 | Remote Similarity | NPD4271 | Approved |
0.6875 | Remote Similarity | NPD7154 | Phase 3 |
0.6875 | Remote Similarity | NPD4266 | Approved |
0.6875 | Remote Similarity | NPD3195 | Phase 2 |
0.6875 | Remote Similarity | NPD3196 | Approved |
0.6875 | Remote Similarity | NPD3194 | Approved |
0.6716 | Remote Similarity | NPD6109 | Phase 1 |
0.6709 | Remote Similarity | NPD4820 | Approved |
0.6709 | Remote Similarity | NPD4821 | Approved |
0.6709 | Remote Similarity | NPD4822 | Approved |
0.6709 | Remote Similarity | NPD4819 | Approved |
0.6667 | Remote Similarity | NPD5362 | Discontinued |
0.6667 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6627 | Remote Similarity | NPD4249 | Approved |
0.662 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.6613 | Remote Similarity | NPD3173 | Approved |
0.6548 | Remote Similarity | NPD4251 | Approved |
0.6548 | Remote Similarity | NPD4250 | Approved |
0.6543 | Remote Similarity | NPD4269 | Approved |
0.6543 | Remote Similarity | NPD4270 | Approved |
0.65 | Remote Similarity | NPD4252 | Approved |
0.6452 | Remote Similarity | NPD5343 | Approved |
0.6429 | Remote Similarity | NPD5786 | Approved |
0.642 | Remote Similarity | NPD4790 | Discontinued |
0.6406 | Remote Similarity | NPD28 | Approved |
0.6406 | Remote Similarity | NPD29 | Approved |
0.6393 | Remote Similarity | NPD4265 | Approved |
0.6393 | Remote Similarity | NPD39 | Approved |
0.6393 | Remote Similarity | NPD4222 | Approved |
0.6341 | Remote Similarity | NPD6435 | Approved |
0.6329 | Remote Similarity | NPD4756 | Discovery |
0.631 | Remote Similarity | NPD5363 | Approved |
0.625 | Remote Similarity | NPD7983 | Approved |
0.6232 | Remote Similarity | NPD585 | Clinical (unspecified phase) |
0.623 | Remote Similarity | NPD6096 | Approved |
0.623 | Remote Similarity | NPD6097 | Approved |
0.622 | Remote Similarity | NPD5369 | Approved |
0.6207 | Remote Similarity | NPD5370 | Suspended |
0.619 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.619 | Remote Similarity | NPD622 | Approved |
0.618 | Remote Similarity | NPD5778 | Approved |
0.618 | Remote Similarity | NPD5779 | Approved |
0.6154 | Remote Similarity | NPD6927 | Phase 3 |
0.6136 | Remote Similarity | NPD5785 | Approved |
0.6136 | Remote Similarity | NPD7838 | Discovery |
0.6129 | Remote Similarity | NPD3174 | Discontinued |
0.6111 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.6098 | Remote Similarity | NPD5368 | Approved |
0.6094 | Remote Similarity | NPD4220 | Pre-registration |
0.6067 | Remote Similarity | NPD4810 | Clinical (unspecified phase) |
0.6067 | Remote Similarity | NPD7637 | Suspended |
0.6066 | Remote Similarity | NPD5326 | Phase 3 |
0.6029 | Remote Similarity | NPD342 | Phase 1 |
0.5978 | Remote Similarity | NPD4792 | Clinical (unspecified phase) |
0.5978 | Remote Similarity | NPD7839 | Suspended |
0.5972 | Remote Similarity | NPD368 | Approved |
0.5955 | Remote Similarity | NPD46 | Approved |
0.5955 | Remote Similarity | NPD6698 | Approved |
0.5882 | Remote Similarity | NPD3730 | Approved |
0.5882 | Remote Similarity | NPD3728 | Approved |
0.5875 | Remote Similarity | NPD8039 | Approved |
0.5851 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.5843 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.5843 | Remote Similarity | NPD6051 | Approved |
0.5843 | Remote Similarity | NPD6101 | Approved |
0.5811 | Remote Similarity | NPD5325 | Clinical (unspecified phase) |
0.5795 | Remote Similarity | NPD7750 | Discontinued |
0.5769 | Remote Similarity | NPD3212 | Clinical (unspecified phase) |
0.5765 | Remote Similarity | NPD5209 | Approved |
0.5753 | Remote Similarity | NPD4193 | Approved |
0.5753 | Remote Similarity | NPD4191 | Approved |
0.5753 | Remote Similarity | NPD4194 | Approved |
0.5753 | Remote Similarity | NPD4192 | Approved |
0.5729 | Remote Similarity | NPD5344 | Discontinued |
0.5714 | Remote Similarity | NPD6411 | Approved |
0.5684 | Remote Similarity | NPD4225 | Approved |
0.5679 | Remote Similarity | NPD8264 | Approved |
0.5663 | Remote Similarity | NPD3732 | Approved |
0.5658 | Remote Similarity | NPD3704 | Approved |
0.5625 | Remote Similarity | NPD4732 | Discontinued |
0.5625 | Remote Similarity | NPD7640 | Approved |
0.5625 | Remote Similarity | NPD7639 | Approved |
0.5612 | Remote Similarity | NPD6647 | Phase 2 |
0.5604 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
PubChem CID   | 6474835 |
ChEMBL   | CHEMBL463808 |
ZINC   |
Molecular Weight:   | 334.21 |
ALogP:   | -1.1515 |
MLogP:   | 3.22 |
XLogP:   | 4.521 |
# Rotatable Bonds:   | 16 |
Polar Surface Area:   | 66.76 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 2 |
# Rings:   | 0 |
# Heavy Atoms:   | 24 |