Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO12641 | Stereospermum chelonoides | Species | Bignoniaceae | Eukaryota | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2620 | Individual Protein | Seed linoleate 9S-lipoxygenase | Glycine max | IC50 | = | 40000 | nM | 24495846 |
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 NPC34671 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 |
---|---|---|
0.963 | High Similarity | NPC138325 |
0.931 | High Similarity | NPC151719 |
0.8667 | High Similarity | NPC471327 |
0.8621 | High Similarity | NPC115959 |
0.8621 | High Similarity | NPC123965 |
0.8438 | Intermediate Similarity | NPC182392 |
0.8276 | Intermediate Similarity | NPC179103 |
0.8276 | Intermediate Similarity | NPC76765 |
0.8125 | Intermediate Similarity | NPC99088 |
0.8125 | Intermediate Similarity | NPC305759 |
0.8125 | Intermediate Similarity | NPC173592 |
0.8065 | Intermediate Similarity | NPC196831 |
0.8 | Intermediate Similarity | NPC138113 |
0.7857 | Intermediate Similarity | NPC88325 |
0.7742 | Intermediate Similarity | NPC60288 |
0.7647 | Intermediate Similarity | NPC92224 |
0.7586 | Intermediate Similarity | NPC266144 |
0.7586 | Intermediate Similarity | NPC31891 |
0.7586 | Intermediate Similarity | NPC266539 |
0.7586 | Intermediate Similarity | NPC287191 |
0.7576 | Intermediate Similarity | NPC62779 |
0.75 | Intermediate Similarity | NPC206088 |
0.75 | Intermediate Similarity | NPC100879 |
0.75 | Intermediate Similarity | NPC3649 |
0.75 | Intermediate Similarity | NPC66577 |
0.7241 | Intermediate Similarity | NPC38513 |
0.7222 | Intermediate Similarity | NPC266298 |
0.7143 | Intermediate Similarity | NPC282119 |
0.7097 | Intermediate Similarity | NPC288991 |
0.7097 | Intermediate Similarity | NPC262789 |
0.7097 | Intermediate Similarity | NPC64176 |
0.7037 | Intermediate Similarity | NPC178306 |
0.6765 | Remote Similarity | NPC213749 |
0.6757 | Remote Similarity | NPC92863 |
0.6757 | Remote Similarity | NPC155880 |
0.6667 | Remote Similarity | NPC225855 |
0.6579 | Remote Similarity | NPC15934 |
0.6579 | Remote Similarity | NPC217923 |
0.6486 | Remote Similarity | NPC76145 |
0.6486 | Remote Similarity | NPC34764 |
0.6486 | Remote Similarity | NPC190810 |
0.6429 | Remote Similarity | NPC76976 |
0.641 | Remote Similarity | NPC329762 |
0.641 | Remote Similarity | NPC27444 |
0.641 | Remote Similarity | NPC103236 |
0.641 | Remote Similarity | NPC183670 |
0.6316 | Remote Similarity | NPC45727 |
0.6316 | Remote Similarity | NPC297643 |
0.6316 | Remote Similarity | NPC34873 |
0.6316 | Remote Similarity | NPC239039 |
0.6316 | Remote Similarity | NPC40434 |
0.6316 | Remote Similarity | NPC229262 |
0.6316 | Remote Similarity | NPC180840 |
0.6316 | Remote Similarity | NPC139717 |
0.6316 | Remote Similarity | NPC48638 |
0.6296 | Remote Similarity | NPC33192 |
0.6286 | Remote Similarity | NPC13217 |
0.6279 | Remote Similarity | NPC44363 |
0.6279 | Remote Similarity | NPC163751 |
0.6279 | Remote Similarity | NPC110234 |
0.6279 | Remote Similarity | NPC323445 |
0.625 | Remote Similarity | NPC218918 |
0.625 | Remote Similarity | NPC33489 |
0.625 | Remote Similarity | NPC144023 |
0.625 | Remote Similarity | NPC120926 |
0.625 | Remote Similarity | NPC269823 |
0.619 | Remote Similarity | NPC145755 |
0.619 | Remote Similarity | NPC108195 |
0.619 | Remote Similarity | NPC138935 |
0.619 | Remote Similarity | NPC267514 |
0.6176 | Remote Similarity | NPC16561 |
0.6154 | Remote Similarity | NPC33761 |
0.6136 | Remote Similarity | NPC91495 |
0.6136 | Remote Similarity | NPC124851 |
0.6098 | Remote Similarity | NPC177470 |
0.6098 | Remote Similarity | NPC256766 |
0.6098 | Remote Similarity | NPC213538 |
0.6098 | Remote Similarity | NPC298710 |
0.6098 | Remote Similarity | NPC149668 |
0.6098 | Remote Similarity | NPC287397 |
0.6098 | Remote Similarity | NPC208936 |
0.6098 | Remote Similarity | NPC67920 |
0.6098 | Remote Similarity | NPC304151 |
0.6053 | Remote Similarity | NPC185839 |
0.6047 | Remote Similarity | NPC49088 |
0.6047 | Remote Similarity | NPC269074 |
0.6047 | Remote Similarity | NPC276825 |
0.6047 | Remote Similarity | NPC239754 |
0.6 | Remote Similarity | NPC98284 |
0.6 | Remote Similarity | NPC17810 |
0.5952 | Remote Similarity | NPC116934 |
0.5952 | Remote Similarity | NPC270796 |
0.5952 | Remote Similarity | NPC252978 |
0.5909 | Remote Similarity | NPC55063 |
0.5909 | Remote Similarity | NPC19834 |
0.5909 | Remote Similarity | NPC180575 |
0.587 | Remote Similarity | NPC249670 |
0.587 | Remote Similarity | NPC474642 |
0.587 | Remote Similarity | NPC473913 |
0.587 | Remote Similarity | NPC59051 |
0.5854 | Remote Similarity | NPC188596 |
0.5854 | Remote Similarity | NPC469969 |
0.5854 | Remote Similarity | NPC469713 |
0.5814 | Remote Similarity | NPC101616 |
0.5789 | Remote Similarity | NPC38497 |
0.5778 | Remote Similarity | NPC471958 |
0.5758 | Remote Similarity | NPC225191 |
0.5758 | Remote Similarity | NPC10183 |
0.5758 | Remote Similarity | NPC179860 |
0.5758 | Remote Similarity | NPC19070 |
0.5758 | Remote Similarity | NPC51067 |
0.575 | Remote Similarity | NPC103213 |
0.575 | Remote Similarity | NPC171978 |
0.575 | Remote Similarity | NPC29091 |
0.575 | Remote Similarity | NPC255042 |
0.575 | Remote Similarity | NPC277382 |
0.575 | Remote Similarity | NPC182840 |
0.5745 | Remote Similarity | NPC262968 |
0.5745 | Remote Similarity | NPC261571 |
0.5745 | Remote Similarity | NPC477458 |
0.5714 | Remote Similarity | NPC108494 |
0.5714 | Remote Similarity | NPC67761 |
0.5714 | Remote Similarity | NPC194586 |
0.5714 | Remote Similarity | NPC209279 |
0.5714 | Remote Similarity | NPC206906 |
0.5714 | Remote Similarity | NPC473912 |
0.5714 | Remote Similarity | NPC51758 |
0.5714 | Remote Similarity | NPC180871 |
0.5714 | Remote Similarity | NPC68889 |
0.5714 | Remote Similarity | NPC88079 |
0.5682 | Remote Similarity | NPC191337 |
0.5682 | Remote Similarity | NPC474202 |
0.5682 | Remote Similarity | NPC160628 |
0.5682 | Remote Similarity | NPC140501 |
0.5682 | Remote Similarity | NPC117572 |
0.5682 | Remote Similarity | NPC474362 |
0.5667 | Remote Similarity | NPC96619 |
0.5652 | Remote Similarity | NPC31194 |
0.5652 | Remote Similarity | NPC248884 |
0.5652 | Remote Similarity | NPC85079 |
0.5652 | Remote Similarity | NPC153538 |
0.5652 | Remote Similarity | NPC5413 |
0.5652 | Remote Similarity | NPC207815 |
0.5652 | Remote Similarity | NPC302310 |
0.5652 | Remote Similarity | NPC22765 |
0.5652 | Remote Similarity | NPC17518 |
0.5652 | Remote Similarity | NPC149821 |
0.5641 | Remote Similarity | NPC201753 |
0.5641 | Remote Similarity | NPC279300 |
0.5625 | Remote Similarity | NPC49494 |
0.5625 | Remote Similarity | NPC188341 |
0.5625 | Remote Similarity | NPC92114 |
0.5625 | Remote Similarity | NPC208638 |
0.561 | Remote Similarity | NPC323278 |
0.561 | Remote Similarity | NPC12319 |
0.561 | Remote Similarity | NPC56917 |
0.561 | Remote Similarity | NPC18205 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC34671 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 |
---|---|---|---|
0.6579 | Remote Similarity | NPD5783 | Phase 3 |
0.6486 | Remote Similarity | NPD319 | Phase 1 |
0.6429 | Remote Similarity | NPD39 | Approved |
0.6047 | Remote Similarity | NPD3174 | Discontinued |
0.6 | Remote Similarity | NPD8262 | Approved |
0.5952 | Remote Similarity | NPD5326 | Phase 3 |
0.5814 | Remote Similarity | NPD6096 | Approved |
0.5814 | Remote Similarity | NPD6097 | Approved |
0.5806 | Remote Similarity | NPD8834 | Discontinued |
0.5778 | Remote Similarity | NPD5343 | Approved |
0.5745 | Remote Similarity | NPD28 | Approved |
0.5745 | Remote Similarity | NPD29 | Approved |
0.5682 | Remote Similarity | NPD4265 | Approved |
0.5682 | Remote Similarity | NPD4222 | Approved |
0.5652 | Remote Similarity | NPD3173 | Approved |
0.561 | Remote Similarity | NPD1153 | Clinical (unspecified phase) |
PubChem CID   | 21597700 |
ChEMBL   | CHEMBL3120703 |
ZINC   |
Molecular Weight:   | 286.27 |
ALogP:   | 2.432 |
MLogP:   | 3.77 |
XLogP:   | 10.426 |
# Rotatable Bonds:   | 15 |
Polar Surface Area:   | 0 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 0 |
# Rings:   | 0 |
# Heavy Atoms:   | 21 |