Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT16 | Organism | Staphylococcus aureus | Staphylococcus aureus | MIC | = | 2570395.78 | nM | 16554156 |
NPT729 | Organism | Micrococcus luteus | Micrococcus luteus | MIC | = | 5128613.84 | nM | 16554156 |
NPT19 | Organism | Escherichia coli | Escherichia coli | MIC | = | 3090295.43 | nM | 16554156 |
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 NPC277333 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 |
---|---|---|
0.9444 | High Similarity | NPC31557 |
0.9444 | High Similarity | NPC28394 |
0.8529 | High Similarity | NPC95174 |
0.8 | Intermediate Similarity | NPC241279 |
0.7619 | Intermediate Similarity | NPC326521 |
0.7111 | Intermediate Similarity | NPC289484 |
0.7111 | Intermediate Similarity | NPC319709 |
0.7083 | Intermediate Similarity | NPC49494 |
0.7083 | Intermediate Similarity | NPC188341 |
0.6875 | Remote Similarity | NPC261571 |
0.6757 | Remote Similarity | NPC147096 |
0.6757 | Remote Similarity | NPC24506 |
0.6757 | Remote Similarity | NPC185041 |
0.6757 | Remote Similarity | NPC112242 |
0.6757 | Remote Similarity | NPC225783 |
0.6757 | Remote Similarity | NPC163556 |
0.6757 | Remote Similarity | NPC236797 |
0.6667 | Remote Similarity | NPC254685 |
0.6667 | Remote Similarity | NPC319110 |
0.6667 | Remote Similarity | NPC329181 |
0.6579 | Remote Similarity | NPC126915 |
0.641 | Remote Similarity | NPC1748 |
0.641 | Remote Similarity | NPC72324 |
0.641 | Remote Similarity | NPC139131 |
0.641 | Remote Similarity | NPC193062 |
0.641 | Remote Similarity | NPC272998 |
0.641 | Remote Similarity | NPC319034 |
0.641 | Remote Similarity | NPC185538 |
0.641 | Remote Similarity | NPC181516 |
0.641 | Remote Similarity | NPC66124 |
0.641 | Remote Similarity | NPC291158 |
0.641 | Remote Similarity | NPC205141 |
0.6296 | Remote Similarity | NPC476537 |
0.6296 | Remote Similarity | NPC216415 |
0.625 | Remote Similarity | NPC121062 |
0.625 | Remote Similarity | NPC29222 |
0.625 | Remote Similarity | NPC96966 |
0.6216 | Remote Similarity | NPC279895 |
0.6154 | Remote Similarity | NPC267243 |
0.6154 | Remote Similarity | NPC122962 |
0.6098 | Remote Similarity | NPC97967 |
0.6047 | Remote Similarity | NPC111686 |
0.6 | Remote Similarity | NPC12231 |
0.6 | Remote Similarity | NPC152759 |
0.5962 | Remote Similarity | NPC270041 |
0.5952 | Remote Similarity | NPC474914 |
0.5952 | Remote Similarity | NPC474392 |
0.5814 | Remote Similarity | NPC177022 |
0.5814 | Remote Similarity | NPC74352 |
0.5769 | Remote Similarity | NPC123814 |
0.5769 | Remote Similarity | NPC474322 |
0.5686 | Remote Similarity | NPC50457 |
0.5667 | Remote Similarity | NPC470108 |
0.5641 | Remote Similarity | NPC110884 |
0.5614 | Remote Similarity | NPC329003 |
0.5614 | Remote Similarity | NPC325550 |
0.5614 | Remote Similarity | NPC326524 |
0.56 | Remote Similarity | NPC193872 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC277333 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 |
---|---|---|---|
0.75 | Intermediate Similarity | NPD9453 | Phase 3 |
0.7111 | Intermediate Similarity | NPD3211 | Approved |
0.6889 | Remote Similarity | NPD1152 | Phase 2 |
0.6757 | Remote Similarity | NPD8794 | Clinical (unspecified phase) |
0.6739 | Remote Similarity | NPD379 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD8622 | Discontinued |
0.641 | Remote Similarity | NPD2272 | Approved |
0.641 | Remote Similarity | NPD5383 | Approved |
0.6 | Remote Similarity | NPD3214 | Discontinued |
0.5769 | Remote Similarity | NPD3215 | Phase 1 |
0.5686 | Remote Similarity | NPD324 | Approved |
PubChem CID   | 69492 |
ChEMBL   | CHEMBL88158 |
ZINC   |
Molecular Weight:   | 227.22 |
ALogP:   | -3.1635 |
MLogP:   | 2.78 |
XLogP:   | 6.838 |
# Rotatable Bonds:   | 14 |
Polar Surface Area:   | 44.08 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 2 |
# Rings:   | 0 |
# Heavy Atoms:   | 16 |