Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Activity | = | 33.65 | % | 20708940 | |
NPT2 | Others | Unspecified | Activity | = | 10.51 | % | 20708940 | |
NPT2 | Others | Unspecified | Activity | = | 13.58 | % | 20708940 | |
NPT2 | Others | Unspecified | Activity | = | 19.37 | % | 20708940 | |
NPT2 | Others | Unspecified | FC | = | 1.5 | 20708940 | ||
NPT2 | Others | Unspecified | FC | = | 2.5 | 20708940 |
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 NPC63182 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 |
---|---|---|
1.0 | High Similarity | NPC52700 |
1.0 | High Similarity | NPC145045 |
1.0 | High Similarity | NPC105329 |
0.9762 | High Similarity | NPC273545 |
0.9286 | High Similarity | NPC176500 |
0.8864 | High Similarity | NPC287231 |
0.8864 | High Similarity | NPC47363 |
0.881 | High Similarity | NPC250028 |
0.881 | High Similarity | NPC256163 |
0.881 | High Similarity | NPC149299 |
0.881 | High Similarity | NPC40597 |
0.8605 | High Similarity | NPC53541 |
0.8571 | High Similarity | NPC94368 |
0.8571 | High Similarity | NPC80234 |
0.8571 | High Similarity | NPC223249 |
0.8478 | Intermediate Similarity | NPC326957 |
0.8409 | Intermediate Similarity | NPC236579 |
0.8409 | Intermediate Similarity | NPC203531 |
0.8372 | Intermediate Similarity | NPC165533 |
0.8333 | Intermediate Similarity | NPC54980 |
0.8333 | Intermediate Similarity | NPC201622 |
0.8333 | Intermediate Similarity | NPC305182 |
0.8333 | Intermediate Similarity | NPC305660 |
0.8333 | Intermediate Similarity | NPC22903 |
0.814 | Intermediate Similarity | NPC31551 |
0.814 | Intermediate Similarity | NPC219536 |
0.7959 | Intermediate Similarity | NPC55678 |
0.7955 | Intermediate Similarity | NPC161097 |
0.7955 | Intermediate Similarity | NPC28598 |
0.7955 | Intermediate Similarity | NPC12156 |
0.7917 | Intermediate Similarity | NPC106872 |
0.7872 | Intermediate Similarity | NPC282440 |
0.7857 | Intermediate Similarity | NPC80641 |
0.7857 | Intermediate Similarity | NPC154642 |
0.7857 | Intermediate Similarity | NPC80396 |
0.7857 | Intermediate Similarity | NPC321699 |
0.7826 | Intermediate Similarity | NPC317128 |
0.78 | Intermediate Similarity | NPC314084 |
0.78 | Intermediate Similarity | NPC287811 |
0.7708 | Intermediate Similarity | NPC328497 |
0.7708 | Intermediate Similarity | NPC324004 |
0.7619 | Intermediate Similarity | NPC196442 |
0.7619 | Intermediate Similarity | NPC156630 |
0.7619 | Intermediate Similarity | NPC301398 |
0.7619 | Intermediate Similarity | NPC223374 |
0.7619 | Intermediate Similarity | NPC86545 |
0.7551 | Intermediate Similarity | NPC200618 |
0.7551 | Intermediate Similarity | NPC131770 |
0.75 | Intermediate Similarity | NPC12438 |
0.75 | Intermediate Similarity | NPC30195 |
0.74 | Intermediate Similarity | NPC26253 |
0.74 | Intermediate Similarity | NPC304162 |
0.7381 | Intermediate Similarity | NPC154396 |
0.7381 | Intermediate Similarity | NPC286498 |
0.7358 | Intermediate Similarity | NPC469937 |
0.7358 | Intermediate Similarity | NPC23155 |
0.7358 | Intermediate Similarity | NPC53463 |
0.7358 | Intermediate Similarity | NPC320588 |
0.7333 | Intermediate Similarity | NPC279026 |
0.7333 | Intermediate Similarity | NPC14227 |
0.7333 | Intermediate Similarity | NPC301585 |
0.7333 | Intermediate Similarity | NPC81263 |
0.7333 | Intermediate Similarity | NPC113928 |
0.7333 | Intermediate Similarity | NPC301696 |
0.7333 | Intermediate Similarity | NPC201844 |
0.7333 | Intermediate Similarity | NPC154186 |
0.7333 | Intermediate Similarity | NPC261080 |
0.7273 | Intermediate Similarity | NPC128996 |
0.7255 | Intermediate Similarity | NPC90904 |
0.7143 | Intermediate Similarity | NPC322892 |
0.7143 | Intermediate Similarity | NPC286695 |
0.7083 | Intermediate Similarity | NPC74845 |
0.7059 | Intermediate Similarity | NPC250919 |
0.7021 | Intermediate Similarity | NPC196924 |
0.7021 | Intermediate Similarity | NPC307783 |
0.7021 | Intermediate Similarity | NPC171736 |
0.7021 | Intermediate Similarity | NPC216630 |
0.7021 | Intermediate Similarity | NPC209970 |
0.7021 | Intermediate Similarity | NPC149184 |
0.7018 | Intermediate Similarity | NPC17935 |
0.7 | Intermediate Similarity | NPC469926 |
0.7 | Intermediate Similarity | NPC157518 |
0.7 | Intermediate Similarity | NPC249754 |
0.6981 | Remote Similarity | NPC310746 |
0.6977 | Remote Similarity | NPC57499 |
0.6957 | Remote Similarity | NPC214610 |
0.6957 | Remote Similarity | NPC294085 |
0.6957 | Remote Similarity | NPC118968 |
0.6957 | Remote Similarity | NPC183424 |
0.6939 | Remote Similarity | NPC469781 |
0.6905 | Remote Similarity | NPC40965 |
0.6905 | Remote Similarity | NPC12904 |
0.6889 | Remote Similarity | NPC14608 |
0.6875 | Remote Similarity | NPC67462 |
0.6863 | Remote Similarity | NPC216130 |
0.6833 | Remote Similarity | NPC314103 |
0.6818 | Remote Similarity | NPC289344 |
0.6818 | Remote Similarity | NPC155872 |
0.68 | Remote Similarity | NPC308301 |
0.6792 | Remote Similarity | NPC100096 |
0.678 | Remote Similarity | NPC306750 |
0.6774 | Remote Similarity | NPC469925 |
0.6739 | Remote Similarity | NPC268826 |
0.6735 | Remote Similarity | NPC255837 |
0.6735 | Remote Similarity | NPC19305 |
0.6735 | Remote Similarity | NPC76051 |
0.6727 | Remote Similarity | NPC319589 |
0.6724 | Remote Similarity | NPC470363 |
0.6667 | Remote Similarity | NPC155263 |
0.6667 | Remote Similarity | NPC82315 |
0.6613 | Remote Similarity | NPC315525 |
0.6613 | Remote Similarity | NPC135043 |
0.661 | Remote Similarity | NPC478126 |
0.6607 | Remote Similarity | NPC128061 |
0.6607 | Remote Similarity | NPC200845 |
0.6607 | Remote Similarity | NPC28779 |
0.6607 | Remote Similarity | NPC10316 |
0.6607 | Remote Similarity | NPC223677 |
0.66 | Remote Similarity | NPC8219 |
0.66 | Remote Similarity | NPC55023 |
0.6562 | Remote Similarity | NPC5714 |
0.6562 | Remote Similarity | NPC144511 |
0.6562 | Remote Similarity | NPC199557 |
0.6562 | Remote Similarity | NPC296522 |
0.6545 | Remote Similarity | NPC71761 |
0.6538 | Remote Similarity | NPC13105 |
0.6531 | Remote Similarity | NPC289686 |
0.6471 | Remote Similarity | NPC166287 |
0.6471 | Remote Similarity | NPC314679 |
0.6471 | Remote Similarity | NPC172042 |
0.6462 | Remote Similarity | NPC472955 |
0.6452 | Remote Similarity | NPC295256 |
0.6441 | Remote Similarity | NPC472019 |
0.6441 | Remote Similarity | NPC226602 |
0.6441 | Remote Similarity | NPC472020 |
0.6406 | Remote Similarity | NPC119838 |
0.6393 | Remote Similarity | NPC54925 |
0.6383 | Remote Similarity | NPC316546 |
0.6364 | Remote Similarity | NPC161366 |
0.6364 | Remote Similarity | NPC470243 |
0.6364 | Remote Similarity | NPC147054 |
0.6346 | Remote Similarity | NPC21844 |
0.6333 | Remote Similarity | NPC472021 |
0.6333 | Remote Similarity | NPC229252 |
0.6333 | Remote Similarity | NPC143857 |
0.6327 | Remote Similarity | NPC103286 |
0.6327 | Remote Similarity | NPC163746 |
0.6308 | Remote Similarity | NPC28526 |
0.6304 | Remote Similarity | NPC301919 |
0.6304 | Remote Similarity | NPC134782 |
0.629 | Remote Similarity | NPC68343 |
0.629 | Remote Similarity | NPC328089 |
0.6279 | Remote Similarity | NPC168982 |
0.6269 | Remote Similarity | NPC473775 |
0.6269 | Remote Similarity | NPC473699 |
0.6269 | Remote Similarity | NPC474100 |
0.6269 | Remote Similarity | NPC51249 |
0.6269 | Remote Similarity | NPC475260 |
0.6269 | Remote Similarity | NPC475232 |
0.6269 | Remote Similarity | NPC474755 |
0.6269 | Remote Similarity | NPC109510 |
0.625 | Remote Similarity | NPC309606 |
0.625 | Remote Similarity | NPC139545 |
0.625 | Remote Similarity | NPC39633 |
0.625 | Remote Similarity | NPC473784 |
0.623 | Remote Similarity | NPC469922 |
0.623 | Remote Similarity | NPC201939 |
0.6226 | Remote Similarity | NPC477878 |
0.6226 | Remote Similarity | NPC68577 |
0.6226 | Remote Similarity | NPC324793 |
0.62 | Remote Similarity | NPC71317 |
0.62 | Remote Similarity | NPC129972 |
0.62 | Remote Similarity | NPC301528 |
0.619 | Remote Similarity | NPC234005 |
0.619 | Remote Similarity | NPC326651 |
0.619 | Remote Similarity | NPC325117 |
0.619 | Remote Similarity | NPC322319 |
0.619 | Remote Similarity | NPC215987 |
0.619 | Remote Similarity | NPC306805 |
0.6182 | Remote Similarity | NPC274261 |
0.6182 | Remote Similarity | NPC291724 |
0.6176 | Remote Similarity | NPC215030 |
0.6176 | Remote Similarity | NPC469643 |
0.6176 | Remote Similarity | NPC55508 |
0.6176 | Remote Similarity | NPC469641 |
0.6176 | Remote Similarity | NPC472966 |
0.6167 | Remote Similarity | NPC475821 |
0.6154 | Remote Similarity | NPC218477 |
0.6136 | Remote Similarity | NPC261991 |
0.6136 | Remote Similarity | NPC49151 |
0.6136 | Remote Similarity | NPC262505 |
0.6136 | Remote Similarity | NPC254713 |
0.6136 | Remote Similarity | NPC179831 |
0.6129 | Remote Similarity | NPC325773 |
0.6129 | Remote Similarity | NPC235788 |
0.6119 | Remote Similarity | NPC184550 |
0.6119 | Remote Similarity | NPC129665 |
0.6119 | Remote Similarity | NPC477641 |
0.6119 | Remote Similarity | NPC185419 |
0.6119 | Remote Similarity | NPC320865 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC63182 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 |
---|---|---|---|
0.8864 | High Similarity | NPD2699 | Approved |
0.7917 | Intermediate Similarity | NPD6125 | Clinical (unspecified phase) |
0.75 | Intermediate Similarity | NPD3206 | Approved |
0.7358 | Intermediate Similarity | NPD3728 | Approved |
0.7358 | Intermediate Similarity | NPD3730 | Approved |
0.7333 | Intermediate Similarity | NPD9448 | Phase 2 |
0.7333 | Intermediate Similarity | NPD633 | Phase 3 |
0.7021 | Intermediate Similarity | NPD2270 | Approved |
0.6957 | Remote Similarity | NPD9655 | Approved |
0.6875 | Remote Similarity | NPD387 | Clinical (unspecified phase) |
0.6727 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.66 | Remote Similarity | NPD3199 | Clinical (unspecified phase) |
0.6471 | Remote Similarity | NPD9430 | Approved |
0.6471 | Remote Similarity | NPD9431 | Approved |
0.6471 | Remote Similarity | NPD634 | Phase 3 |
0.6452 | Remote Similarity | NPD9496 | Clinical (unspecified phase) |
0.6441 | Remote Similarity | NPD3198 | Approved |
0.6406 | Remote Similarity | NPD229 | Approved |
0.6226 | Remote Similarity | NPD2266 | Phase 2 |
0.6222 | Remote Similarity | NPD900 | Approved |
0.617 | Remote Similarity | NPD9449 | Clinical (unspecified phase) |
0.614 | Remote Similarity | NPD615 | Clinical (unspecified phase) |
0.6119 | Remote Similarity | NPD2256 | Clinical (unspecified phase) |
0.5965 | Remote Similarity | NPD631 | Approved |
0.5965 | Remote Similarity | NPD630 | Approved |
0.5957 | Remote Similarity | NPD370 | Phase 3 |
0.5926 | Remote Similarity | NPD622 | Approved |
0.5909 | Remote Similarity | NPD8278 | Approved |
0.5893 | Remote Similarity | NPD29 | Approved |
0.5893 | Remote Similarity | NPD28 | Approved |
0.5882 | Remote Similarity | NPD5777 | Approved |
0.5821 | Remote Similarity | NPD8277 | Approved |
0.5789 | Remote Similarity | NPD3186 | Phase 1 |
0.5781 | Remote Similarity | NPD3197 | Phase 1 |
0.5781 | Remote Similarity | NPD7909 | Approved |
0.5745 | Remote Similarity | NPD9447 | Approved |
0.5714 | Remote Similarity | NPD8989 | Approved |
0.569 | Remote Similarity | NPD3172 | Approved |
0.5682 | Remote Similarity | NPD62 | Approved |
0.5667 | Remote Similarity | NPD73 | Approved |
0.5616 | Remote Similarity | NPD4802 | Phase 2 |
0.5616 | Remote Similarity | NPD4238 | Approved |
0.56 | Remote Similarity | NPD9450 | Approved |
0.56 | Remote Similarity | NPD77 | Approved |
PubChem CID   | 12237820 |
ChEMBL   | CHEMBL1269378 |
ZINC   |
Molecular Weight:   | 198.16 |
ALogP:   | -2.3594 |
MLogP:   | 2.56 |
XLogP:   | 4.451 |
# Rotatable Bonds:   | 8 |
Polar Surface Area:   | 26.3 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 0 |
# Rings:   | 1 |
# Heavy Atoms:   | 14 |