Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT176 | Organism | Artemia salina | Artemia salina | LC50 | > | 100 | ug/ml | 22500574 |
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 NPC470782 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 |
---|---|---|
0.9429 | High Similarity | NPC126186 |
0.942 | High Similarity | NPC470781 |
0.8571 | High Similarity | NPC470783 |
0.8429 | Intermediate Similarity | NPC128005 |
0.8429 | Intermediate Similarity | NPC84182 |
0.8261 | Intermediate Similarity | NPC243964 |
0.7875 | Intermediate Similarity | NPC475542 |
0.7867 | Intermediate Similarity | NPC76297 |
0.7867 | Intermediate Similarity | NPC214532 |
0.7867 | Intermediate Similarity | NPC196007 |
0.7848 | Intermediate Similarity | NPC312315 |
0.7662 | Intermediate Similarity | NPC161774 |
0.7662 | Intermediate Similarity | NPC209156 |
0.7662 | Intermediate Similarity | NPC266888 |
0.7662 | Intermediate Similarity | NPC256312 |
0.7407 | Intermediate Similarity | NPC31756 |
0.7356 | Intermediate Similarity | NPC275715 |
0.7317 | Intermediate Similarity | NPC476156 |
0.7317 | Intermediate Similarity | NPC476117 |
0.7317 | Intermediate Similarity | NPC476137 |
0.7317 | Intermediate Similarity | NPC476243 |
0.7229 | Intermediate Similarity | NPC476302 |
0.716 | Intermediate Similarity | NPC329077 |
0.6951 | Remote Similarity | NPC59867 |
0.6889 | Remote Similarity | NPC475801 |
0.6889 | Remote Similarity | NPC474593 |
0.6875 | Remote Similarity | NPC29326 |
0.6818 | Remote Similarity | NPC477539 |
0.6813 | Remote Similarity | NPC474576 |
0.6739 | Remote Similarity | NPC62263 |
0.6739 | Remote Similarity | NPC173763 |
0.6739 | Remote Similarity | NPC471098 |
0.6735 | Remote Similarity | NPC476877 |
0.6632 | Remote Similarity | NPC473597 |
0.6632 | Remote Similarity | NPC134504 |
0.6632 | Remote Similarity | NPC47076 |
0.66 | Remote Similarity | NPC476876 |
0.6528 | Remote Similarity | NPC275727 |
0.6495 | Remote Similarity | NPC475440 |
0.6471 | Remote Similarity | NPC325902 |
0.641 | Remote Similarity | NPC160661 |
0.6337 | Remote Similarity | NPC128303 |
0.6329 | Remote Similarity | NPC287693 |
0.6327 | Remote Similarity | NPC475758 |
0.6296 | Remote Similarity | NPC322274 |
0.6286 | Remote Similarity | NPC476875 |
0.6277 | Remote Similarity | NPC477538 |
0.6275 | Remote Similarity | NPC241394 |
0.6263 | Remote Similarity | NPC475791 |
0.6263 | Remote Similarity | NPC13175 |
0.6139 | Remote Similarity | NPC471097 |
0.6139 | Remote Similarity | NPC475149 |
0.6117 | Remote Similarity | NPC475637 |
0.6087 | Remote Similarity | NPC89051 |
0.6087 | Remote Similarity | NPC43246 |
0.6055 | Remote Similarity | NPC296043 |
0.6022 | Remote Similarity | NPC210456 |
0.6022 | Remote Similarity | NPC163352 |
0.6 | Remote Similarity | NPC315806 |
0.6 | Remote Similarity | NPC319753 |
0.6 | Remote Similarity | NPC329216 |
0.6 | Remote Similarity | NPC320221 |
0.6 | Remote Similarity | NPC233034 |
0.5978 | Remote Similarity | NPC325723 |
0.5976 | Remote Similarity | NPC34291 |
0.5976 | Remote Similarity | NPC126664 |
0.593 | Remote Similarity | NPC327272 |
0.5926 | Remote Similarity | NPC12514 |
0.5926 | Remote Similarity | NPC294883 |
0.5895 | Remote Similarity | NPC315063 |
0.5895 | Remote Similarity | NPC322966 |
0.5876 | Remote Similarity | NPC315237 |
0.5872 | Remote Similarity | NPC471202 |
0.5872 | Remote Similarity | NPC63191 |
0.5865 | Remote Similarity | NPC323720 |
0.5854 | Remote Similarity | NPC135539 |
0.5854 | Remote Similarity | NPC141156 |
0.5854 | Remote Similarity | NPC184150 |
0.5854 | Remote Similarity | NPC196359 |
0.5854 | Remote Similarity | NPC78312 |
0.5854 | Remote Similarity | NPC221764 |
0.5849 | Remote Similarity | NPC67009 |
0.5842 | Remote Similarity | NPC220234 |
0.5824 | Remote Similarity | NPC184473 |
0.5789 | Remote Similarity | NPC160688 |
0.5783 | Remote Similarity | NPC254617 |
0.5783 | Remote Similarity | NPC306763 |
0.5783 | Remote Similarity | NPC474469 |
0.5783 | Remote Similarity | NPC266242 |
0.5783 | Remote Similarity | NPC74555 |
0.5761 | Remote Similarity | NPC106780 |
0.5745 | Remote Similarity | NPC469363 |
0.5733 | Remote Similarity | NPC272396 |
0.5714 | Remote Similarity | NPC311668 |
0.5714 | Remote Similarity | NPC475715 |
0.5714 | Remote Similarity | NPC473419 |
0.5714 | Remote Similarity | NPC10262 |
0.5714 | Remote Similarity | NPC65832 |
0.5714 | Remote Similarity | NPC475127 |
0.5702 | Remote Similarity | NPC470652 |
0.5701 | Remote Similarity | NPC296143 |
0.5699 | Remote Similarity | NPC112842 |
0.5699 | Remote Similarity | NPC71339 |
0.569 | Remote Similarity | NPC50520 |
0.5679 | Remote Similarity | NPC57420 |
0.5679 | Remote Similarity | NPC145658 |
0.5673 | Remote Similarity | NPC5864 |
0.5673 | Remote Similarity | NPC301148 |
0.5673 | Remote Similarity | NPC124554 |
0.5663 | Remote Similarity | NPC59221 |
0.5657 | Remote Similarity | NPC36985 |
0.5657 | Remote Similarity | NPC17892 |
0.5652 | Remote Similarity | NPC315188 |
0.5652 | Remote Similarity | NPC84128 |
0.5652 | Remote Similarity | NPC53858 |
0.5647 | Remote Similarity | NPC163538 |
0.5647 | Remote Similarity | NPC115800 |
0.5625 | Remote Similarity | NPC8087 |
0.5625 | Remote Similarity | NPC62507 |
0.5619 | Remote Similarity | NPC198344 |
0.5614 | Remote Similarity | NPC469899 |
0.561 | Remote Similarity | NPC472609 |
0.56 | Remote Similarity | NPC73765 |
0.56 | Remote Similarity | NPC283698 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC470782 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 |
---|---|---|---|
0.7647 | Intermediate Similarity | NPD3177 | Phase 3 |
0.7143 | Intermediate Similarity | NPD2683 | Discontinued |
0.7011 | Intermediate Similarity | NPD3723 | Clinical (unspecified phase) |
0.7 | Intermediate Similarity | NPD4780 | Clinical (unspecified phase) |
0.6849 | Remote Similarity | NPD8951 | Approved |
0.6813 | Remote Similarity | NPD4261 | Phase 1 |
0.6795 | Remote Similarity | NPD322 | Phase 1 |
0.6628 | Remote Similarity | NPD7763 | Phase 2 |
0.6628 | Remote Similarity | NPD7762 | Phase 2 |
0.6526 | Remote Similarity | NPD7841 | Clinical (unspecified phase) |
0.6438 | Remote Similarity | NPD1456 | Approved |
0.6404 | Remote Similarity | NPD9577 | Approved |
0.6392 | Remote Similarity | NPD8038 | Phase 2 |
0.6364 | Remote Similarity | NPD1125 | Discovery |
0.6351 | Remote Similarity | NPD9425 | Approved |
0.6333 | Remote Similarity | NPD9401 | Discovery |
0.6264 | Remote Similarity | NPD7760 | Phase 2 |
0.6264 | Remote Similarity | NPD7759 | Phase 2 |
0.6087 | Remote Similarity | NPD9580 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD9581 | Clinical (unspecified phase) |
0.6078 | Remote Similarity | NPD6122 | Discontinued |
0.6024 | Remote Similarity | NPD2220 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD9653 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD9440 | Discontinued |
0.5977 | Remote Similarity | NPD9199 | Approved |
0.5976 | Remote Similarity | NPD9443 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD581 | Approved |
0.5921 | Remote Similarity | NPD583 | Approved |
0.5921 | Remote Similarity | NPD843 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD584 | Approved |
0.5904 | Remote Similarity | NPD620 | Approved |
0.5895 | Remote Similarity | NPD755 | Phase 3 |
0.5854 | Remote Similarity | NPD8868 | Approved |
0.5833 | Remote Similarity | NPD9565 | Discontinued |
0.5783 | Remote Similarity | NPD9444 | Discontinued |
0.5773 | Remote Similarity | NPD251 | Approved |
0.5765 | Remote Similarity | NPD9446 | Approved |
0.5747 | Remote Similarity | NPD9198 | Approved |
0.5714 | Remote Similarity | NPD9558 | Phase 3 |
0.5714 | Remote Similarity | NPD9556 | Approved |
0.5714 | Remote Similarity | NPD279 | Clinical (unspecified phase) |
0.5699 | Remote Similarity | NPD280 | Approved |
0.5682 | Remote Similarity | NPD9407 | Approved |
0.566 | Remote Similarity | NPD1385 | Discontinued |
0.5652 | Remote Similarity | NPD9560 | Approved |
0.5652 | Remote Similarity | NPD9561 | Approved |
0.5647 | Remote Similarity | NPD9649 | Approved |
0.5647 | Remote Similarity | NPD1439 | Clinical (unspecified phase) |
0.5638 | Remote Similarity | NPD9557 | Clinical (unspecified phase) |
0.5625 | Remote Similarity | NPD3192 | Approved |
0.5625 | Remote Similarity | NPD867 | Phase 3 |
0.5625 | Remote Similarity | NPD868 | Phase 3 |
0.5625 | Remote Similarity | NPD3193 | Approved |
0.5616 | Remote Similarity | NPD8950 | Approved |
0.56 | Remote Similarity | NPD9639 | Clinical (unspecified phase) |
PubChem CID   | 9815587 |
ChEMBL   | CHEMBL2229108 |
ZINC   |
Molecular Weight:   | 200.08 |
ALogP:   | -2.2664 |
MLogP:   | 1.68 |
XLogP:   | -1.932 |
# Rotatable Bonds:   | 4 |
Polar Surface Area:   | 93.36 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 3 |
# Rings:   | 2 |
# Heavy Atoms:   | 14 |