Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | DOI[10.1038/nbt.2488] | |||
NPO20338 | Mus musculus | Species | Muridae | Eukaryota |
PMID[19425150] |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Ki | = | 500 | nM | 20056424 |
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 NPC317680 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 |
---|---|---|
0.7755 | Intermediate Similarity | NPC310220 |
0.7308 | Intermediate Similarity | NPC133771 |
0.6897 | Remote Similarity | NPC6883 |
0.6885 | Remote Similarity | NPC323945 |
0.6774 | Remote Similarity | NPC320296 |
0.6724 | Remote Similarity | NPC65985 |
0.6667 | Remote Similarity | NPC3547 |
0.6667 | Remote Similarity | NPC198377 |
0.6607 | Remote Similarity | NPC328954 |
0.6607 | Remote Similarity | NPC293378 |
0.6604 | Remote Similarity | NPC320624 |
0.65 | Remote Similarity | NPC60830 |
0.65 | Remote Similarity | NPC68743 |
0.6452 | Remote Similarity | NPC179624 |
0.6441 | Remote Similarity | NPC19676 |
0.6441 | Remote Similarity | NPC323401 |
0.6296 | Remote Similarity | NPC318951 |
0.6275 | Remote Similarity | NPC325454 |
0.6078 | Remote Similarity | NPC206924 |
0.6038 | Remote Similarity | NPC240109 |
0.6034 | Remote Similarity | NPC46254 |
0.6032 | Remote Similarity | NPC61567 |
0.6 | Remote Similarity | NPC250870 |
0.6 | Remote Similarity | NPC191084 |
0.6 | Remote Similarity | NPC168052 |
0.5926 | Remote Similarity | NPC325307 |
0.5926 | Remote Similarity | NPC322956 |
0.5918 | Remote Similarity | NPC125575 |
0.5915 | Remote Similarity | NPC470268 |
0.5909 | Remote Similarity | NPC469923 |
0.5902 | Remote Similarity | NPC196612 |
0.5846 | Remote Similarity | NPC475821 |
0.5758 | Remote Similarity | NPC469921 |
0.5738 | Remote Similarity | NPC277878 |
0.5714 | Remote Similarity | NPC319680 |
0.5714 | Remote Similarity | NPC280532 |
0.566 | Remote Similarity | NPC38930 |
0.5625 | Remote Similarity | NPC174368 |
0.5614 | Remote Similarity | NPC242655 |
0.5614 | Remote Similarity | NPC38891 |
0.56 | Remote Similarity | NPC94196 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC317680 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 |
---|---|---|---|
0.6792 | Remote Similarity | NPD8974 | Clinical (unspecified phase) |
0.6607 | Remote Similarity | NPD71 | Approved |
0.6607 | Remote Similarity | NPD9126 | Approved |
0.6607 | Remote Similarity | NPD9129 | Approved |
0.6429 | Remote Similarity | NPD70 | Approved |
0.6429 | Remote Similarity | NPD108 | Approved |
0.6429 | Remote Similarity | NPD9127 | Approved |
0.6429 | Remote Similarity | NPD9121 | Approved |
0.6429 | Remote Similarity | NPD9130 | Phase 3 |
0.6429 | Remote Similarity | NPD9128 | Approved |
0.6429 | Remote Similarity | NPD9122 | Approved |
0.6429 | Remote Similarity | NPD109 | Approved |
0.6429 | Remote Similarity | NPD9125 | Approved |
0.6429 | Remote Similarity | NPD9123 | Approved |
0.6429 | Remote Similarity | NPD9124 | Approved |
0.6296 | Remote Similarity | NPD8975 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD9116 | Phase 1 |
0.5738 | Remote Similarity | NPD9010 | Approved |
0.5738 | Remote Similarity | NPD65 | Approved |
0.5738 | Remote Similarity | NPD64 | Approved |
0.5738 | Remote Similarity | NPD8960 | Approved |
0.5738 | Remote Similarity | NPD9008 | Approved |
0.5738 | Remote Similarity | NPD66 | Approved |
0.5738 | Remote Similarity | NPD9011 | Approved |
0.5738 | Remote Similarity | NPD72 | Approved |
0.5738 | Remote Similarity | NPD9009 | Approved |
0.5738 | Remote Similarity | NPD9007 | Approved |
0.5625 | Remote Similarity | NPD73 | Approved |
PubChem CID   | 439418 |
ChEMBL   | CHEMBL235881 |
ZINC   |
Molecular Weight:   | 308.01 |
ALogP:   | -1.463 |
MLogP:   | 0.8 |
XLogP:   | -3.314 |
# Rotatable Bonds:   | 14 |
Polar Surface Area:   | 190.44 |
# H-Bond Aceptor:   | 10 |
# H-Bond Donor:   | 5 |
# Rings:   | 0 |
# Heavy Atoms:   | 18 |