Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO19434.1 | Securinega suffruticosa | Under-species | NA | NA | wood |
PMID[18052029] |
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 NPC44514 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 |
---|---|---|
0.9897 | High Similarity | NPC93179 |
0.8095 | Intermediate Similarity | NPC473289 |
0.7921 | Intermediate Similarity | NPC110875 |
0.7921 | Intermediate Similarity | NPC299808 |
0.7921 | Intermediate Similarity | NPC118844 |
0.7921 | Intermediate Similarity | NPC72183 |
0.7615 | Intermediate Similarity | NPC75523 |
0.7315 | Intermediate Similarity | NPC270813 |
0.7 | Intermediate Similarity | NPC174463 |
0.6885 | Remote Similarity | NPC230849 |
0.688 | Remote Similarity | NPC477987 |
0.688 | Remote Similarity | NPC329401 |
0.6842 | Remote Similarity | NPC477000 |
0.6842 | Remote Similarity | NPC477001 |
0.6723 | Remote Similarity | NPC43648 |
0.6667 | Remote Similarity | NPC477985 |
0.6667 | Remote Similarity | NPC477988 |
0.6667 | Remote Similarity | NPC326386 |
0.6667 | Remote Similarity | NPC471087 |
0.6667 | Remote Similarity | NPC138534 |
0.6667 | Remote Similarity | NPC477986 |
0.6609 | Remote Similarity | NPC173690 |
0.6609 | Remote Similarity | NPC80439 |
0.6609 | Remote Similarity | NPC6271 |
0.6609 | Remote Similarity | NPC279833 |
0.6581 | Remote Similarity | NPC271562 |
0.6552 | Remote Similarity | NPC64168 |
0.6552 | Remote Similarity | NPC133420 |
0.6529 | Remote Similarity | NPC193471 |
0.6529 | Remote Similarity | NPC130124 |
0.6512 | Remote Similarity | NPC471086 |
0.6512 | Remote Similarity | NPC478136 |
0.6504 | Remote Similarity | NPC469997 |
0.6504 | Remote Similarity | NPC65045 |
0.65 | Remote Similarity | NPC47857 |
0.65 | Remote Similarity | NPC168758 |
0.65 | Remote Similarity | NPC58281 |
0.65 | Remote Similarity | NPC181510 |
0.648 | Remote Similarity | NPC11379 |
0.6457 | Remote Similarity | NPC323168 |
0.6457 | Remote Similarity | NPC477990 |
0.6457 | Remote Similarity | NPC111162 |
0.6457 | Remote Similarity | NPC477989 |
0.6457 | Remote Similarity | NPC293550 |
0.6452 | Remote Similarity | NPC235625 |
0.6385 | Remote Similarity | NPC173173 |
0.6364 | Remote Similarity | NPC316984 |
0.6364 | Remote Similarity | NPC30911 |
0.6356 | Remote Similarity | NPC86906 |
0.6341 | Remote Similarity | NPC474984 |
0.632 | Remote Similarity | NPC284656 |
0.632 | Remote Similarity | NPC106791 |
0.632 | Remote Similarity | NPC201889 |
0.6311 | Remote Similarity | NPC474995 |
0.6308 | Remote Similarity | NPC317654 |
0.6308 | Remote Similarity | NPC96010 |
0.6299 | Remote Similarity | NPC23963 |
0.6299 | Remote Similarity | NPC470000 |
0.6296 | Remote Similarity | NPC130436 |
0.6296 | Remote Similarity | NPC469861 |
0.6296 | Remote Similarity | NPC469860 |
0.629 | Remote Similarity | NPC28280 |
0.629 | Remote Similarity | NPC304646 |
0.623 | Remote Similarity | NPC474459 |
0.6179 | Remote Similarity | NPC474452 |
0.6174 | Remote Similarity | NPC241426 |
0.6165 | Remote Similarity | NPC215507 |
0.6165 | Remote Similarity | NPC307165 |
0.6154 | Remote Similarity | NPC469999 |
0.6154 | Remote Similarity | NPC188785 |
0.6148 | Remote Similarity | NPC472313 |
0.614 | Remote Similarity | NPC150041 |
0.6111 | Remote Similarity | NPC96055 |
0.6098 | Remote Similarity | NPC79238 |
0.6078 | Remote Similarity | NPC470994 |
0.6074 | Remote Similarity | NPC133089 |
0.6071 | Remote Similarity | NPC159568 |
0.6061 | Remote Similarity | NPC476951 |
0.6047 | Remote Similarity | NPC476504 |
0.6034 | Remote Similarity | NPC476344 |
0.6031 | Remote Similarity | NPC26285 |
0.6016 | Remote Similarity | NPC471261 |
0.6016 | Remote Similarity | NPC113012 |
0.6016 | Remote Similarity | NPC122926 |
0.6 | Remote Similarity | NPC281104 |
0.6 | Remote Similarity | NPC120335 |
0.6 | Remote Similarity | NPC475988 |
0.596 | Remote Similarity | NPC472266 |
0.595 | Remote Similarity | NPC101106 |
0.595 | Remote Similarity | NPC135216 |
0.5942 | Remote Similarity | NPC82129 |
0.5935 | Remote Similarity | NPC474891 |
0.5926 | Remote Similarity | NPC471218 |
0.592 | Remote Similarity | NPC80834 |
0.592 | Remote Similarity | NPC469968 |
0.5909 | Remote Similarity | NPC476503 |
0.5906 | Remote Similarity | NPC470538 |
0.5905 | Remote Similarity | NPC189206 |
0.5902 | Remote Similarity | NPC250187 |
0.5902 | Remote Similarity | NPC46981 |
0.59 | Remote Similarity | NPC276290 |
0.5897 | Remote Similarity | NPC4834 |
0.5882 | Remote Similarity | NPC314792 |
0.5882 | Remote Similarity | NPC474348 |
0.5868 | Remote Similarity | NPC469604 |
0.5868 | Remote Similarity | NPC212874 |
0.5854 | Remote Similarity | NPC287572 |
0.5854 | Remote Similarity | NPC470535 |
0.5854 | Remote Similarity | NPC471636 |
0.5854 | Remote Similarity | NPC474969 |
0.5854 | Remote Similarity | NPC476034 |
0.5852 | Remote Similarity | NPC470539 |
0.5849 | Remote Similarity | NPC184737 |
0.584 | Remote Similarity | NPC469455 |
0.5833 | Remote Similarity | NPC474244 |
0.5814 | Remote Similarity | NPC9714 |
0.5814 | Remote Similarity | NPC476952 |
0.5806 | Remote Similarity | NPC470536 |
0.5806 | Remote Similarity | NPC218602 |
0.58 | Remote Similarity | NPC475342 |
0.5798 | Remote Similarity | NPC474985 |
0.5797 | Remote Similarity | NPC120420 |
0.5794 | Remote Similarity | NPC295444 |
0.5794 | Remote Similarity | NPC268327 |
0.5794 | Remote Similarity | NPC273215 |
0.5794 | Remote Similarity | NPC279383 |
0.5789 | Remote Similarity | NPC321197 |
0.5785 | Remote Similarity | NPC265094 |
0.5781 | Remote Similarity | NPC288629 |
0.5772 | Remote Similarity | NPC313272 |
0.5772 | Remote Similarity | NPC319537 |
0.5772 | Remote Similarity | NPC176773 |
0.5766 | Remote Similarity | NPC261730 |
0.5763 | Remote Similarity | NPC52820 |
0.576 | Remote Similarity | NPC127578 |
0.5758 | Remote Similarity | NPC478138 |
0.5755 | Remote Similarity | NPC187568 |
0.5755 | Remote Similarity | NPC41780 |
0.5755 | Remote Similarity | NPC99864 |
0.5752 | Remote Similarity | NPC93411 |
0.575 | Remote Similarity | NPC474873 |
0.5748 | Remote Similarity | NPC478137 |
0.5746 | Remote Similarity | NPC309525 |
0.5741 | Remote Similarity | NPC268827 |
0.5738 | Remote Similarity | NPC87919 |
0.5736 | Remote Similarity | NPC147707 |
0.5727 | Remote Similarity | NPC170286 |
0.5726 | Remote Similarity | NPC119225 |
0.5726 | Remote Similarity | NPC476261 |
0.5726 | Remote Similarity | NPC25033 |
0.5726 | Remote Similarity | NPC470382 |
0.5726 | Remote Similarity | NPC471635 |
0.5714 | Remote Similarity | NPC29501 |
0.5714 | Remote Similarity | NPC297058 |
0.5714 | Remote Similarity | NPC91604 |
0.5714 | Remote Similarity | NPC147238 |
0.5714 | Remote Similarity | NPC315170 |
0.5704 | Remote Similarity | NPC280903 |
0.5701 | Remote Similarity | NPC299235 |
0.5693 | Remote Similarity | NPC478139 |
0.5692 | Remote Similarity | NPC471673 |
0.569 | Remote Similarity | NPC7349 |
0.5686 | Remote Similarity | NPC232812 |
0.5682 | Remote Similarity | NPC242692 |
0.5682 | Remote Similarity | NPC315188 |
0.5678 | Remote Similarity | NPC194132 |
0.5678 | Remote Similarity | NPC476449 |
0.5676 | Remote Similarity | NPC30486 |
0.5676 | Remote Similarity | NPC475975 |
0.5673 | Remote Similarity | NPC16349 |
0.5673 | Remote Similarity | NPC222244 |
0.5669 | Remote Similarity | NPC476498 |
0.5669 | Remote Similarity | NPC478024 |
0.5669 | Remote Similarity | NPC269340 |
0.5662 | Remote Similarity | NPC474847 |
0.566 | Remote Similarity | NPC123360 |
0.5659 | Remote Similarity | NPC30196 |
0.5656 | Remote Similarity | NPC473254 |
0.5656 | Remote Similarity | NPC469895 |
0.5652 | Remote Similarity | NPC316401 |
0.5648 | Remote Similarity | NPC471768 |
0.5643 | Remote Similarity | NPC239252 |
0.5643 | Remote Similarity | NPC471256 |
0.5643 | Remote Similarity | NPC473703 |
0.5641 | Remote Similarity | NPC140277 |
0.5641 | Remote Similarity | NPC105490 |
0.5639 | Remote Similarity | NPC472458 |
0.5639 | Remote Similarity | NPC20035 |
0.5636 | Remote Similarity | NPC178676 |
0.5636 | Remote Similarity | NPC173609 |
0.5635 | Remote Similarity | NPC63511 |
0.5635 | Remote Similarity | NPC469603 |
0.5631 | Remote Similarity | NPC37929 |
0.5631 | Remote Similarity | NPC469660 |
0.5631 | Remote Similarity | NPC64234 |
0.5625 | Remote Similarity | NPC75810 |
0.5625 | Remote Similarity | NPC474013 |
0.5625 | Remote Similarity | NPC319991 |
0.5625 | Remote Similarity | NPC471795 |
0.562 | Remote Similarity | NPC144714 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC44514 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 |
---|---|---|---|
0.6364 | Remote Similarity | NPD2204 | Approved |
0.6354 | Remote Similarity | NPD616 | Clinical (unspecified phase) |
0.6228 | Remote Similarity | NPD5349 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD2569 | Approved |
0.6 | Remote Similarity | NPD2567 | Approved |
0.595 | Remote Similarity | NPD4211 | Phase 1 |
0.5906 | Remote Similarity | NPD7755 | Approved |
0.5906 | Remote Similarity | NPD7754 | Approved |
0.5873 | Remote Similarity | NPD1376 | Discontinued |
0.5794 | Remote Similarity | NPD4572 | Approved |
0.5794 | Remote Similarity | NPD4573 | Approved |
0.5794 | Remote Similarity | NPD4571 | Approved |
0.5772 | Remote Similarity | NPD812 | Approved |
0.5772 | Remote Similarity | NPD811 | Approved |
0.5772 | Remote Similarity | NPD810 | Approved |
0.5758 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.5755 | Remote Similarity | NPD8415 | Approved |
0.5714 | Remote Similarity | NPD8387 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD2201 | Approved |
0.5686 | Remote Similarity | NPD2697 | Approved |
0.5686 | Remote Similarity | NPD2696 | Approved |
0.5686 | Remote Similarity | NPD2694 | Approved |
0.5686 | Remote Similarity | NPD2695 | Approved |
0.5669 | Remote Similarity | NPD8078 | Approved |
0.5669 | Remote Similarity | NPD8077 | Approved |
0.5656 | Remote Similarity | NPD2258 | Approved |
0.5656 | Remote Similarity | NPD2259 | Approved |
0.5643 | Remote Similarity | NPD4621 | Approved |
0.5643 | Remote Similarity | NPD4619 | Approved |
0.563 | Remote Similarity | NPD8451 | Approved |
0.5612 | Remote Similarity | NPD2613 | Approved |
0.5603 | Remote Similarity | NPD3614 | Approved |
0.5603 | Remote Similarity | NPD2574 | Discontinued |
0.5603 | Remote Similarity | NPD2573 | Approved |
0.5603 | Remote Similarity | NPD3090 | Approved |
0.5603 | Remote Similarity | NPD3089 | Approved |
0.5603 | Remote Similarity | NPD2566 | Approved |
0.5603 | Remote Similarity | NPD3616 | Approved |
0.5603 | Remote Similarity | NPD4746 | Phase 3 |
0.5603 | Remote Similarity | NPD4745 | Approved |
0.5603 | Remote Similarity | NPD3087 | Approved |
0.5603 | Remote Similarity | NPD3615 | Approved |
0.5603 | Remote Similarity | NPD3088 | Approved |
0.5603 | Remote Similarity | NPD2571 | Approved |
0.5603 | Remote Similarity | NPD2572 | Clinical (unspecified phase) |
0.5603 | Remote Similarity | NPD2570 | Approved |
PubChem CID   | 24762834 |
ChEMBL   | CHEMBL398307 |
ZINC   |
Molecular Weight:   | 249.14 |
ALogP:   | -0.9347 |
MLogP:   | 2.56 |
XLogP:   | 0.355 |
# Rotatable Bonds:   | 2 |
Polar Surface Area:   | 38.77 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 0 |
# Rings:   | 4 |
# Heavy Atoms:   | 18 |