Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO6232.53 | Streptomyces griseus sank 60196 | Subspecies | Streptomycetaceae | Bacteria | StreptomeDB* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT5885 | Individual Protein | Phospho-N-acetylmuramoyl-pentapeptide-transferase | Escherichia coli K-12 | IC50 | = | 0.01 | ug/ml | 14611839 |
NPT602 | Organism | Mycobacterium smegmatis | Mycobacterium smegmatis | MIC | = | 12.5 | ug/ml | 14611839 |
NPT1513 | Organism | Mycobacterium avium | Mycobacterium avium | MIC | = | 8 | ug/ml | 14611839 |
NPT86 | Organism | Mycobacterium intracellulare | Mycobacterium intracellulare | MIC | = | 8 | ug/ml | 14611839 |
NPT1828 | Organism | Mycobacterium kansasii | Mycobacterium kansasii | MIC | = | 8 | ug/ml | 14611839 |
NPT5885 | Individual Protein | Phospho-N-acetylmuramoyl-pentapeptide-transferase | Escherichia coli K-12 | IC50 | = | 0.01 | ug/ml | 14611838 |
NPT5885 | Individual Protein | Phospho-N-acetylmuramoyl-pentapeptide-transferase | Escherichia coli K-12 | IC50 | = | 18 | nM | 14611838 |
NPT602 | Organism | Mycobacterium smegmatis | Mycobacterium smegmatis | MIC | = | 12.5 | ug/ml | 14611838 |
NPT1513 | Organism | Mycobacterium avium | Mycobacterium avium | MIC | = | 8 | ug/ml | 14611838 |
NPT86 | Organism | Mycobacterium intracellulare | Mycobacterium intracellulare | MIC | = | 8 | ug/ml | 14611838 |
NPT1828 | Organism | Mycobacterium kansasii | Mycobacterium kansasii | MIC | = | 8 | ug/ml | 14611838 |
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 NPC315058 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 |
---|---|---|
0.9746 | High Similarity | NPC313962 |
0.7258 | Intermediate Similarity | NPC149843 |
0.7258 | Intermediate Similarity | NPC155087 |
0.687 | Remote Similarity | NPC89051 |
0.687 | Remote Similarity | NPC43246 |
0.6693 | Remote Similarity | NPC329277 |
0.6642 | Remote Similarity | NPC325750 |
0.6641 | Remote Similarity | NPC478024 |
0.6617 | Remote Similarity | NPC313813 |
0.6612 | Remote Similarity | NPC36985 |
0.6612 | Remote Similarity | NPC17892 |
0.6609 | Remote Similarity | NPC106780 |
0.6557 | Remote Similarity | NPC283698 |
0.6557 | Remote Similarity | NPC73765 |
0.6525 | Remote Similarity | NPC210456 |
0.6525 | Remote Similarity | NPC163352 |
0.6475 | Remote Similarity | NPC284651 |
0.6443 | Remote Similarity | NPC247776 |
0.6443 | Remote Similarity | NPC475278 |
0.6443 | Remote Similarity | NPC309450 |
0.6443 | Remote Similarity | NPC304299 |
0.6443 | Remote Similarity | NPC475266 |
0.6417 | Remote Similarity | NPC315063 |
0.6393 | Remote Similarity | NPC182632 |
0.6393 | Remote Similarity | NPC282705 |
0.6364 | Remote Similarity | NPC324390 |
0.6333 | Remote Similarity | NPC71866 |
0.6329 | Remote Similarity | NPC316244 |
0.6311 | Remote Similarity | NPC322594 |
0.6311 | Remote Similarity | NPC320249 |
0.629 | Remote Similarity | NPC35269 |
0.629 | Remote Similarity | NPC23454 |
0.629 | Remote Similarity | NPC262312 |
0.629 | Remote Similarity | NPC70323 |
0.6281 | Remote Similarity | NPC171116 |
0.6279 | Remote Similarity | NPC55336 |
0.6271 | Remote Similarity | NPC112842 |
0.6271 | Remote Similarity | NPC228638 |
0.6271 | Remote Similarity | NPC71339 |
0.626 | Remote Similarity | NPC15851 |
0.626 | Remote Similarity | NPC475603 |
0.626 | Remote Similarity | NPC309898 |
0.626 | Remote Similarity | NPC475125 |
0.626 | Remote Similarity | NPC61894 |
0.626 | Remote Similarity | NPC473581 |
0.626 | Remote Similarity | NPC186840 |
0.626 | Remote Similarity | NPC111567 |
0.626 | Remote Similarity | NPC263545 |
0.626 | Remote Similarity | NPC473950 |
0.626 | Remote Similarity | NPC473604 |
0.6259 | Remote Similarity | NPC245534 |
0.6241 | Remote Similarity | NPC251122 |
0.619 | Remote Similarity | NPC45313 |
0.6179 | Remote Similarity | NPC74672 |
0.6179 | Remote Similarity | NPC43074 |
0.6179 | Remote Similarity | NPC209047 |
0.6179 | Remote Similarity | NPC242503 |
0.6179 | Remote Similarity | NPC139782 |
0.616 | Remote Similarity | NPC157353 |
0.616 | Remote Similarity | NPC3568 |
0.616 | Remote Similarity | NPC282088 |
0.616 | Remote Similarity | NPC156782 |
0.616 | Remote Similarity | NPC54961 |
0.616 | Remote Similarity | NPC192066 |
0.616 | Remote Similarity | NPC17290 |
0.616 | Remote Similarity | NPC256570 |
0.616 | Remote Similarity | NPC158445 |
0.6136 | Remote Similarity | NPC315426 |
0.6127 | Remote Similarity | NPC36254 |
0.6107 | Remote Similarity | NPC74035 |
0.6099 | Remote Similarity | NPC273185 |
0.608 | Remote Similarity | NPC324516 |
0.608 | Remote Similarity | NPC318166 |
0.6063 | Remote Similarity | NPC183449 |
0.6063 | Remote Similarity | NPC8098 |
0.6063 | Remote Similarity | NPC197294 |
0.6061 | Remote Similarity | NPC475918 |
0.6048 | Remote Similarity | NPC327344 |
0.6032 | Remote Similarity | NPC317639 |
0.5987 | Remote Similarity | NPC315210 |
0.5987 | Remote Similarity | NPC315848 |
0.5985 | Remote Similarity | NPC241597 |
0.5984 | Remote Similarity | NPC62927 |
0.5984 | Remote Similarity | NPC190334 |
0.5972 | Remote Similarity | NPC471263 |
0.5969 | Remote Similarity | NPC328914 |
0.5954 | Remote Similarity | NPC477198 |
0.5948 | Remote Similarity | NPC329077 |
0.594 | Remote Similarity | NPC201128 |
0.5912 | Remote Similarity | NPC314306 |
0.5906 | Remote Similarity | NPC318142 |
0.5814 | Remote Similarity | NPC328779 |
0.5781 | Remote Similarity | NPC280946 |
0.5781 | Remote Similarity | NPC226769 |
0.5781 | Remote Similarity | NPC6166 |
0.5767 | Remote Similarity | NPC477398 |
0.5764 | Remote Similarity | NPC471262 |
0.5763 | Remote Similarity | NPC325902 |
0.5762 | Remote Similarity | NPC471256 |
0.5746 | Remote Similarity | NPC166242 |
0.5746 | Remote Similarity | NPC322449 |
0.5746 | Remote Similarity | NPC189854 |
0.5746 | Remote Similarity | NPC92874 |
0.5746 | Remote Similarity | NPC62845 |
0.5738 | Remote Similarity | NPC229249 |
0.5736 | Remote Similarity | NPC120887 |
0.5736 | Remote Similarity | NPC90240 |
0.5734 | Remote Similarity | NPC470652 |
0.5733 | Remote Similarity | NPC314361 |
0.5724 | Remote Similarity | NPC471255 |
0.5714 | Remote Similarity | NPC316807 |
0.5704 | Remote Similarity | NPC325900 |
0.5704 | Remote Similarity | NPC10897 |
0.5697 | Remote Similarity | NPC317377 |
0.5697 | Remote Similarity | NPC321485 |
0.5692 | Remote Similarity | NPC475503 |
0.568 | Remote Similarity | NPC328806 |
0.5676 | Remote Similarity | NPC163783 |
0.5674 | Remote Similarity | NPC296043 |
0.5672 | Remote Similarity | NPC314398 |
0.5672 | Remote Similarity | NPC239705 |
0.5672 | Remote Similarity | NPC314413 |
0.5655 | Remote Similarity | NPC20035 |
0.5634 | Remote Similarity | NPC329216 |
0.5612 | Remote Similarity | NPC29501 |
0.5606 | Remote Similarity | NPC315170 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC315058 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 |
---|---|---|---|
0.6993 | Remote Similarity | NPD7761 | Suspended |
0.687 | Remote Similarity | NPD9581 | Clinical (unspecified phase) |
0.687 | Remote Similarity | NPD9580 | Clinical (unspecified phase) |
0.6807 | Remote Similarity | NPD1686 | Approved |
0.6693 | Remote Similarity | NPD3129 | Phase 3 |
0.6639 | Remote Similarity | NPD9565 | Discontinued |
0.6614 | Remote Similarity | NPD3128 | Phase 3 |
0.6585 | Remote Similarity | NPD502 | Approved |
0.6557 | Remote Similarity | NPD9639 | Clinical (unspecified phase) |
0.6535 | Remote Similarity | NPD1407 | Approved |
0.6525 | Remote Similarity | NPD241 | Discontinued |
0.6496 | Remote Similarity | NPD9557 | Clinical (unspecified phase) |
0.6493 | Remote Similarity | NPD3139 | Phase 3 |
0.6449 | Remote Similarity | NPD6436 | Phase 3 |
0.6444 | Remote Similarity | NPD6935 | Phase 3 |
0.6444 | Remote Similarity | NPD6936 | Clinical (unspecified phase) |
0.6434 | Remote Similarity | NPD1385 | Discontinued |
0.6418 | Remote Similarity | NPD3138 | Phase 3 |
0.6417 | Remote Similarity | NPD755 | Phase 3 |
0.6417 | Remote Similarity | NPD841 | Approved |
0.6341 | Remote Similarity | NPD501 | Phase 1 |
0.6328 | Remote Similarity | NPD1061 | Clinical (unspecified phase) |
0.6311 | Remote Similarity | NPD251 | Approved |
0.6277 | Remote Similarity | NPD7756 | Clinical (unspecified phase) |
0.6271 | Remote Similarity | NPD280 | Approved |
0.6202 | Remote Similarity | NPD244 | Clinical (unspecified phase) |
0.6179 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
0.6167 | Remote Similarity | NPD240 | Phase 3 |
0.6154 | Remote Similarity | NPD9556 | Approved |
0.6154 | Remote Similarity | NPD9558 | Phase 3 |
0.6142 | Remote Similarity | NPD5789 | Clinical (unspecified phase) |
0.6116 | Remote Similarity | NPD1760 | Approved |
0.6102 | Remote Similarity | NPD9561 | Approved |
0.6102 | Remote Similarity | NPD9560 | Approved |
0.605 | Remote Similarity | NPD9546 | Phase 2 |
0.6048 | Remote Similarity | NPD6943 | Clinical (unspecified phase) |
0.6048 | Remote Similarity | NPD9585 | Discontinued |
0.6043 | Remote Similarity | NPD6918 | Phase 1 |
0.6033 | Remote Similarity | NPD170 | Approved |
0.6031 | Remote Similarity | NPD4743 | Phase 2 |
0.6014 | Remote Similarity | NPD4832 | Approved |
0.6014 | Remote Similarity | NPD4830 | Approved |
0.6014 | Remote Similarity | NPD869 | Approved |
0.6014 | Remote Similarity | NPD4831 | Approved |
0.6 | Remote Similarity | NPD238 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD239 | Phase 2 |
0.6 | Remote Similarity | NPD6421 | Discontinued |
0.6 | Remote Similarity | NPD9533 | Phase 2 |
0.5985 | Remote Similarity | NPD3731 | Phase 3 |
0.5985 | Remote Similarity | NPD6946 | Approved |
0.5984 | Remote Similarity | NPD9602 | Phase 3 |
0.5984 | Remote Similarity | NPD9604 | Approved |
0.5984 | Remote Similarity | NPD762 | Discontinued |
0.5984 | Remote Similarity | NPD9603 | Phase 3 |
0.5969 | Remote Similarity | NPD1454 | Phase 3 |
0.5969 | Remote Similarity | NPD1455 | Phase 3 |
0.5912 | Remote Similarity | NPD6429 | Approved |
0.5912 | Remote Similarity | NPD7914 | Suspended |
0.5912 | Remote Similarity | NPD6430 | Approved |
0.5909 | Remote Similarity | NPD8045 | Clinical (unspecified phase) |
0.5904 | Remote Similarity | NPD5219 | Approved |
0.5904 | Remote Similarity | NPD5218 | Approved |
0.5902 | Remote Similarity | NPD9562 | Discovery |
0.5891 | Remote Similarity | NPD192 | Phase 2 |
0.5882 | Remote Similarity | NPD1804 | Phase 2 |
0.5882 | Remote Similarity | NPD1805 | Phase 2 |
0.5878 | Remote Similarity | NPD7651 | Approved |
0.5862 | Remote Similarity | NPD4816 | Clinical (unspecified phase) |
0.5846 | Remote Similarity | NPD223 | Clinical (unspecified phase) |
0.5821 | Remote Similarity | NPD1428 | Phase 2 |
0.5808 | Remote Similarity | NPD4521 | Clinical (unspecified phase) |
0.5785 | Remote Similarity | NPD9559 | Phase 1 |
0.5785 | Remote Similarity | NPD9529 | Phase 1 |
0.5748 | Remote Similarity | NPD279 | Clinical (unspecified phase) |
0.5738 | Remote Similarity | NPD9601 | Approved |
0.5738 | Remote Similarity | NPD205 | Approved |
0.5692 | Remote Similarity | NPD6428 | Approved |
0.5672 | Remote Similarity | NPD3161 | Clinical (unspecified phase) |
0.5634 | Remote Similarity | NPD7992 | Clinical (unspecified phase) |
0.5615 | Remote Similarity | NPD514 | Clinical (unspecified phase) |
0.5606 | Remote Similarity | NPD765 | Discontinued |
PubChem CID   | 5487121 |
ChEMBL   | CHEMBL96695 |
ZINC   |
Molecular Weight:   | 569.20 |
ALogP:   | -4.5013 |
MLogP:   | 2.12 |
XLogP:   | -1.842 |
# Rotatable Bonds:   | 16 |
Polar Surface Area:   | 259.77 |
# H-Bond Aceptor:   | 17 |
# H-Bond Donor:   | 8 |
# Rings:   | 4 |
# Heavy Atoms:   | 40 |