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 | = | 6.25 | ug/ml | 14611839 |
NPT1513 | Organism | Mycobacterium avium | Mycobacterium avium | MIC | = | 8 | ug/ml | 14611839 |
NPT86 | Organism | Mycobacterium intracellulare | Mycobacterium intracellulare | MIC | = | 4 | ug/ml | 14611839 |
NPT1828 | Organism | Mycobacterium kansasii | Mycobacterium kansasii | MIC | = | 16 | 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 | = | 17 | nM | 14611838 |
NPT602 | Organism | Mycobacterium smegmatis | Mycobacterium smegmatis | MIC | = | 6.25 | ug/ml | 14611838 |
NPT1513 | Organism | Mycobacterium avium | Mycobacterium avium | MIC | = | 8 | ug/ml | 14611838 |
NPT86 | Organism | Mycobacterium intracellulare | Mycobacterium intracellulare | MIC | = | 4 | ug/ml | 14611838 |
NPT1828 | Organism | Mycobacterium kansasii | Mycobacterium kansasii | MIC | = | 16 | 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 NPC313962 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 | NPC315058 |
0.7087 | Intermediate Similarity | NPC155087 |
0.7087 | Intermediate Similarity | NPC149843 |
0.6842 | Remote Similarity | NPC313813 |
0.6742 | Remote Similarity | NPC478024 |
0.6695 | Remote Similarity | NPC89051 |
0.6695 | Remote Similarity | NPC43246 |
0.6538 | Remote Similarity | NPC329277 |
0.6519 | Remote Similarity | NPC316244 |
0.6504 | Remote Similarity | NPC263545 |
0.6504 | Remote Similarity | NPC309898 |
0.6504 | Remote Similarity | NPC186840 |
0.6504 | Remote Similarity | NPC473950 |
0.6504 | Remote Similarity | NPC282705 |
0.6504 | Remote Similarity | NPC182632 |
0.6504 | Remote Similarity | NPC61894 |
0.6504 | Remote Similarity | NPC111567 |
0.6504 | Remote Similarity | NPC473581 |
0.6504 | Remote Similarity | NPC15851 |
0.6504 | Remote Similarity | NPC475125 |
0.6504 | Remote Similarity | NPC473604 |
0.6504 | Remote Similarity | NPC475603 |
0.65 | Remote Similarity | NPC325750 |
0.6452 | Remote Similarity | NPC36985 |
0.6452 | Remote Similarity | NPC17892 |
0.6441 | Remote Similarity | NPC106780 |
0.6424 | Remote Similarity | NPC247776 |
0.6424 | Remote Similarity | NPC475266 |
0.6424 | Remote Similarity | NPC475278 |
0.6424 | Remote Similarity | NPC304299 |
0.6424 | Remote Similarity | NPC309450 |
0.6423 | Remote Similarity | NPC242503 |
0.6423 | Remote Similarity | NPC139782 |
0.6423 | Remote Similarity | NPC74672 |
0.6423 | Remote Similarity | NPC43074 |
0.6423 | Remote Similarity | NPC209047 |
0.64 | Remote Similarity | NPC192066 |
0.64 | Remote Similarity | NPC73765 |
0.64 | Remote Similarity | NPC158445 |
0.64 | Remote Similarity | NPC70323 |
0.64 | Remote Similarity | NPC3568 |
0.64 | Remote Similarity | NPC283698 |
0.64 | Remote Similarity | NPC262312 |
0.64 | Remote Similarity | NPC157353 |
0.64 | Remote Similarity | NPC54961 |
0.64 | Remote Similarity | NPC35269 |
0.64 | Remote Similarity | NPC23454 |
0.64 | Remote Similarity | NPC256570 |
0.64 | Remote Similarity | NPC156782 |
0.64 | Remote Similarity | NPC282088 |
0.64 | Remote Similarity | NPC17290 |
0.6364 | Remote Similarity | NPC163352 |
0.6364 | Remote Similarity | NPC210456 |
0.6338 | Remote Similarity | NPC284651 |
0.6336 | Remote Similarity | NPC74035 |
0.6316 | Remote Similarity | NPC71866 |
0.6312 | Remote Similarity | NPC273185 |
0.6299 | Remote Similarity | NPC197294 |
0.6299 | Remote Similarity | NPC45313 |
0.6299 | Remote Similarity | NPC8098 |
0.6299 | Remote Similarity | NPC183449 |
0.6288 | Remote Similarity | NPC475918 |
0.626 | Remote Similarity | NPC55336 |
0.626 | Remote Similarity | NPC315063 |
0.6222 | Remote Similarity | NPC251122 |
0.621 | Remote Similarity | NPC324390 |
0.6183 | Remote Similarity | NPC477198 |
0.616 | Remote Similarity | NPC322594 |
0.616 | Remote Similarity | NPC320249 |
0.6131 | Remote Similarity | NPC314306 |
0.6129 | Remote Similarity | NPC171116 |
0.6127 | Remote Similarity | NPC245534 |
0.6119 | Remote Similarity | NPC315426 |
0.6116 | Remote Similarity | NPC71339 |
0.6116 | Remote Similarity | NPC228638 |
0.6116 | Remote Similarity | NPC112842 |
0.6045 | Remote Similarity | NPC201128 |
0.6 | Remote Similarity | NPC36254 |
0.6 | Remote Similarity | NPC318142 |
0.5974 | Remote Similarity | NPC315210 |
0.5974 | Remote Similarity | NPC315848 |
0.5971 | Remote Similarity | NPC241597 |
0.5959 | Remote Similarity | NPC471263 |
0.5951 | Remote Similarity | NPC477398 |
0.5944 | Remote Similarity | NPC470652 |
0.5938 | Remote Similarity | NPC318166 |
0.5938 | Remote Similarity | NPC324516 |
0.5933 | Remote Similarity | NPC314361 |
0.5923 | Remote Similarity | NPC475503 |
0.5906 | Remote Similarity | NPC327344 |
0.5891 | Remote Similarity | NPC317639 |
0.5887 | Remote Similarity | NPC296043 |
0.5879 | Remote Similarity | NPC321485 |
0.5879 | Remote Similarity | NPC317377 |
0.5862 | Remote Similarity | NPC20035 |
0.5845 | Remote Similarity | NPC329216 |
0.584 | Remote Similarity | NPC190334 |
0.584 | Remote Similarity | NPC62927 |
0.5833 | Remote Similarity | NPC328914 |
0.5827 | Remote Similarity | NPC29501 |
0.5798 | Remote Similarity | NPC329077 |
0.5782 | Remote Similarity | NPC470654 |
0.5782 | Remote Similarity | NPC470650 |
0.5782 | Remote Similarity | NPC470653 |
0.5772 | Remote Similarity | NPC163783 |
0.5759 | Remote Similarity | NPC142761 |
0.5758 | Remote Similarity | NPC475646 |
0.5753 | Remote Similarity | NPC471262 |
0.5753 | Remote Similarity | NPC469943 |
0.5735 | Remote Similarity | NPC189854 |
0.5735 | Remote Similarity | NPC166242 |
0.5735 | Remote Similarity | NPC322449 |
0.5735 | Remote Similarity | NPC92874 |
0.5735 | Remote Similarity | NPC62845 |
0.5734 | Remote Similarity | NPC6531 |
0.5714 | Remote Similarity | NPC471255 |
0.5714 | Remote Similarity | NPC476875 |
0.5714 | Remote Similarity | NPC315170 |
0.5693 | Remote Similarity | NPC10897 |
0.5693 | Remote Similarity | NPC325900 |
0.5689 | Remote Similarity | NPC319334 |
0.5689 | Remote Similarity | NPC327517 |
0.5689 | Remote Similarity | NPC322372 |
0.5687 | Remote Similarity | NPC477519 |
0.5685 | Remote Similarity | NPC160688 |
0.5685 | Remote Similarity | NPC315188 |
0.5682 | Remote Similarity | NPC328779 |
0.5667 | Remote Similarity | NPC470651 |
0.5667 | Remote Similarity | NPC470655 |
0.5664 | Remote Similarity | NPC30196 |
0.5662 | Remote Similarity | NPC476877 |
0.5662 | Remote Similarity | NPC314398 |
0.5662 | Remote Similarity | NPC239705 |
0.5662 | Remote Similarity | NPC314413 |
0.5649 | Remote Similarity | NPC226769 |
0.5649 | Remote Similarity | NPC280946 |
0.5649 | Remote Similarity | NPC6166 |
0.5649 | Remote Similarity | NPC471256 |
0.562 | Remote Similarity | NPC325902 |
0.561 | Remote Similarity | NPC471420 |
0.5608 | Remote Similarity | NPC50520 |
0.5606 | Remote Similarity | NPC120887 |
0.5606 | Remote Similarity | NPC90240 |
0.56 | Remote Similarity | NPC229249 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC313962 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 |
---|---|---|---|
0.7083 | Intermediate Similarity | NPD7761 | Suspended |
0.6695 | Remote Similarity | NPD9580 | Clinical (unspecified phase) |
0.6695 | Remote Similarity | NPD9581 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD6935 | Phase 3 |
0.6667 | Remote Similarity | NPD6936 | Clinical (unspecified phase) |
0.6639 | Remote Similarity | NPD1686 | Approved |
0.6538 | Remote Similarity | NPD3129 | Phase 3 |
0.6496 | Remote Similarity | NPD7756 | Clinical (unspecified phase) |
0.6475 | Remote Similarity | NPD9565 | Discontinued |
0.6462 | Remote Similarity | NPD3128 | Phase 3 |
0.6429 | Remote Similarity | NPD6436 | Phase 3 |
0.6429 | Remote Similarity | NPD502 | Approved |
0.6423 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
0.64 | Remote Similarity | NPD9639 | Clinical (unspecified phase) |
0.6385 | Remote Similarity | NPD1407 | Approved |
0.6378 | Remote Similarity | NPD5789 | Clinical (unspecified phase) |
0.6364 | Remote Similarity | NPD241 | Discontinued |
0.635 | Remote Similarity | NPD3139 | Phase 3 |
0.6333 | Remote Similarity | NPD9557 | Clinical (unspecified phase) |
0.6288 | Remote Similarity | NPD1385 | Discontinued |
0.6277 | Remote Similarity | NPD3138 | Phase 3 |
0.626 | Remote Similarity | NPD841 | Approved |
0.626 | Remote Similarity | NPD755 | Phase 3 |
0.6259 | Remote Similarity | NPD6918 | Phase 1 |
0.6222 | Remote Similarity | NPD6421 | Discontinued |
0.6212 | Remote Similarity | NPD6946 | Approved |
0.619 | Remote Similarity | NPD501 | Phase 1 |
0.6183 | Remote Similarity | NPD1061 | Clinical (unspecified phase) |
0.616 | Remote Similarity | NPD6943 | Clinical (unspecified phase) |
0.616 | Remote Similarity | NPD251 | Approved |
0.6131 | Remote Similarity | NPD7914 | Suspended |
0.6131 | Remote Similarity | NPD6430 | Approved |
0.6131 | Remote Similarity | NPD6429 | Approved |
0.6116 | Remote Similarity | NPD280 | Approved |
0.6115 | Remote Similarity | NPD869 | Approved |
0.6069 | Remote Similarity | NPD4816 | Clinical (unspecified phase) |
0.6061 | Remote Similarity | NPD244 | Clinical (unspecified phase) |
0.6016 | Remote Similarity | NPD240 | Phase 3 |
0.6 | Remote Similarity | NPD9558 | Phase 3 |
0.6 | Remote Similarity | NPD4830 | Approved |
0.6 | Remote Similarity | NPD4832 | Approved |
0.6 | Remote Similarity | NPD4831 | Approved |
0.6 | Remote Similarity | NPD9556 | Approved |
0.5985 | Remote Similarity | NPD7651 | Approved |
0.5971 | Remote Similarity | NPD3731 | Phase 3 |
0.5968 | Remote Similarity | NPD1760 | Approved |
0.595 | Remote Similarity | NPD9560 | Approved |
0.595 | Remote Similarity | NPD9561 | Approved |
0.5906 | Remote Similarity | NPD9585 | Discontinued |
0.5902 | Remote Similarity | NPD9546 | Phase 2 |
0.5896 | Remote Similarity | NPD8045 | Clinical (unspecified phase) |
0.5896 | Remote Similarity | NPD4743 | Phase 2 |
0.5887 | Remote Similarity | NPD170 | Approved |
0.5854 | Remote Similarity | NPD239 | Phase 2 |
0.5854 | Remote Similarity | NPD238 | Clinical (unspecified phase) |
0.5854 | Remote Similarity | NPD9533 | Phase 2 |
0.5846 | Remote Similarity | NPD762 | Discontinued |
0.5845 | Remote Similarity | NPD7992 | Clinical (unspecified phase) |
0.584 | Remote Similarity | NPD9603 | Phase 3 |
0.584 | Remote Similarity | NPD9604 | Approved |
0.584 | Remote Similarity | NPD9602 | Phase 3 |
0.5833 | Remote Similarity | NPD1454 | Phase 3 |
0.5833 | Remote Similarity | NPD1455 | Phase 3 |
0.5799 | Remote Similarity | NPD5219 | Approved |
0.5799 | Remote Similarity | NPD5218 | Approved |
0.576 | Remote Similarity | NPD9562 | Discovery |
0.5758 | Remote Similarity | NPD192 | Phase 2 |
0.5755 | Remote Similarity | NPD1804 | Phase 2 |
0.5755 | Remote Similarity | NPD1805 | Phase 2 |
0.5735 | Remote Similarity | NPD2700 | Approved |
0.5714 | Remote Similarity | NPD223 | Clinical (unspecified phase) |
0.5706 | Remote Similarity | NPD4521 | Clinical (unspecified phase) |
0.5693 | Remote Similarity | NPD1428 | Phase 2 |
0.5691 | Remote Similarity | NPD2691 | Clinical (unspecified phase) |
0.5682 | Remote Similarity | NPD6428 | Approved |
0.5645 | Remote Similarity | NPD9559 | Phase 1 |
0.5645 | Remote Similarity | NPD9529 | Phase 1 |
0.5615 | Remote Similarity | NPD279 | Clinical (unspecified phase) |
0.56 | Remote Similarity | NPD9601 | Approved |
0.56 | Remote Similarity | NPD205 | Approved |
PubChem CID   | 5495616 |
ChEMBL   | CHEMBL95027 |
ZINC   |
Molecular Weight:   | 583.21 |
ALogP:   | -4.3999 |
MLogP:   | 2.23 |
XLogP:   | -1.316 |
# Rotatable Bonds:   | 17 |
Polar Surface Area:   | 259.77 |
# H-Bond Aceptor:   | 17 |
# H-Bond Donor:   | 8 |
# Rings:   | 4 |
# Heavy Atoms:   | 41 |