Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | > | 10000 | nM | 21070010 | |
NPT2 | Others | Unspecified | IC50 | > | 10000 | nM | 25129868 | |
NPT2 | Others | Unspecified | IC50 | > | 10000 | nM | 20553004 | |
NPT179 | Cell Line | A2780 | Homo sapiens | IC50 | > | 10000 | nM | PubChem BioAssay data set |
NPT2 | Others | Unspecified | IC50 | = | 3480 | nM | 22014228 | |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | > | 10000 | nM | PubChem BioAssay data set |
NPT2 | Others | Unspecified | Activity | = | 94.2 | % | 8496706 |
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 NPC142712 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 |
---|---|---|
0.9839 | High Similarity | NPC48079 |
0.9683 | High Similarity | NPC472741 |
0.9531 | High Similarity | NPC129829 |
0.9531 | High Similarity | NPC254037 |
0.9508 | High Similarity | NPC114891 |
0.9385 | High Similarity | NPC192192 |
0.9385 | High Similarity | NPC231945 |
0.9344 | High Similarity | NPC71460 |
0.9344 | High Similarity | NPC218585 |
0.9344 | High Similarity | NPC148174 |
0.9242 | High Similarity | NPC127094 |
0.9219 | High Similarity | NPC473230 |
0.9219 | High Similarity | NPC475884 |
0.9206 | High Similarity | NPC41577 |
0.9206 | High Similarity | NPC474380 |
0.9206 | High Similarity | NPC473276 |
0.9091 | High Similarity | NPC282454 |
0.9062 | High Similarity | NPC44122 |
0.9048 | High Similarity | NPC281540 |
0.9048 | High Similarity | NPC159654 |
0.9048 | High Similarity | NPC167995 |
0.9048 | High Similarity | NPC69149 |
0.9048 | High Similarity | NPC118937 |
0.8971 | High Similarity | NPC477508 |
0.8955 | High Similarity | NPC100586 |
0.8955 | High Similarity | NPC109457 |
0.8955 | High Similarity | NPC157422 |
0.8955 | High Similarity | NPC473279 |
0.8939 | High Similarity | NPC66407 |
0.8939 | High Similarity | NPC470830 |
0.8939 | High Similarity | NPC241085 |
0.8939 | High Similarity | NPC107919 |
0.8939 | High Similarity | NPC299948 |
0.8939 | High Similarity | NPC477820 |
0.8906 | High Similarity | NPC260116 |
0.8906 | High Similarity | NPC80463 |
0.8889 | High Similarity | NPC290791 |
0.8889 | High Similarity | NPC292419 |
0.8852 | High Similarity | NPC476735 |
0.8841 | High Similarity | NPC195155 |
0.8841 | High Similarity | NPC240235 |
0.8841 | High Similarity | NPC178383 |
0.8841 | High Similarity | NPC231256 |
0.8841 | High Similarity | NPC212879 |
0.8841 | High Similarity | NPC104387 |
0.8841 | High Similarity | NPC174964 |
0.8841 | High Similarity | NPC97534 |
0.8806 | High Similarity | NPC251201 |
0.8806 | High Similarity | NPC232925 |
0.8806 | High Similarity | NPC63588 |
0.8714 | High Similarity | NPC78067 |
0.8714 | High Similarity | NPC475742 |
0.8714 | High Similarity | NPC5767 |
0.8714 | High Similarity | NPC14112 |
0.8714 | High Similarity | NPC278091 |
0.8714 | High Similarity | NPC86305 |
0.8714 | High Similarity | NPC93662 |
0.8696 | High Similarity | NPC25511 |
0.8696 | High Similarity | NPC192638 |
0.8696 | High Similarity | NPC62657 |
0.8676 | High Similarity | NPC195530 |
0.8676 | High Similarity | NPC252182 |
0.8676 | High Similarity | NPC470071 |
0.8676 | High Similarity | NPC187471 |
0.8676 | High Similarity | NPC1340 |
0.8676 | High Similarity | NPC478103 |
0.8657 | High Similarity | NPC99264 |
0.8636 | High Similarity | NPC63190 |
0.8636 | High Similarity | NPC204233 |
0.8592 | High Similarity | NPC143133 |
0.8592 | High Similarity | NPC202540 |
0.8592 | High Similarity | NPC212241 |
0.8592 | High Similarity | NPC221420 |
0.8592 | High Similarity | NPC298168 |
0.8592 | High Similarity | NPC248830 |
0.8592 | High Similarity | NPC119355 |
0.8592 | High Similarity | NPC23884 |
0.8551 | High Similarity | NPC473238 |
0.8551 | High Similarity | NPC232112 |
0.8551 | High Similarity | NPC470610 |
0.8551 | High Similarity | NPC472341 |
0.8551 | High Similarity | NPC153719 |
0.8548 | High Similarity | NPC162685 |
0.8507 | High Similarity | NPC475893 |
0.8507 | High Similarity | NPC469987 |
0.8472 | Intermediate Similarity | NPC102708 |
0.8472 | Intermediate Similarity | NPC42853 |
0.8429 | Intermediate Similarity | NPC228994 |
0.8429 | Intermediate Similarity | NPC478130 |
0.8429 | Intermediate Similarity | NPC48795 |
0.8429 | Intermediate Similarity | NPC192501 |
0.8429 | Intermediate Similarity | NPC10476 |
0.8429 | Intermediate Similarity | NPC304499 |
0.8406 | Intermediate Similarity | NPC151018 |
0.8406 | Intermediate Similarity | NPC157777 |
0.8406 | Intermediate Similarity | NPC320549 |
0.8406 | Intermediate Similarity | NPC111234 |
0.8406 | Intermediate Similarity | NPC58057 |
0.8406 | Intermediate Similarity | NPC131506 |
0.8406 | Intermediate Similarity | NPC156277 |
0.8387 | Intermediate Similarity | NPC135438 |
0.8356 | Intermediate Similarity | NPC475727 |
0.8356 | Intermediate Similarity | NPC472742 |
0.8356 | Intermediate Similarity | NPC49599 |
0.8356 | Intermediate Similarity | NPC220379 |
0.8356 | Intermediate Similarity | NPC116119 |
0.8356 | Intermediate Similarity | NPC80297 |
0.8356 | Intermediate Similarity | NPC49627 |
0.8333 | Intermediate Similarity | NPC243469 |
0.8333 | Intermediate Similarity | NPC190827 |
0.8333 | Intermediate Similarity | NPC475943 |
0.831 | Intermediate Similarity | NPC158208 |
0.831 | Intermediate Similarity | NPC196136 |
0.831 | Intermediate Similarity | NPC70982 |
0.831 | Intermediate Similarity | NPC91387 |
0.831 | Intermediate Similarity | NPC243027 |
0.831 | Intermediate Similarity | NPC231680 |
0.831 | Intermediate Similarity | NPC185536 |
0.831 | Intermediate Similarity | NPC212733 |
0.831 | Intermediate Similarity | NPC3403 |
0.831 | Intermediate Similarity | NPC273366 |
0.831 | Intermediate Similarity | NPC230704 |
0.831 | Intermediate Similarity | NPC270306 |
0.831 | Intermediate Similarity | NPC317242 |
0.8308 | Intermediate Similarity | NPC236099 |
0.8308 | Intermediate Similarity | NPC209686 |
0.8308 | Intermediate Similarity | NPC249078 |
0.8286 | Intermediate Similarity | NPC253805 |
0.8261 | Intermediate Similarity | NPC45296 |
0.8243 | Intermediate Similarity | NPC475679 |
0.8235 | Intermediate Similarity | NPC474756 |
0.8194 | Intermediate Similarity | NPC472486 |
0.8194 | Intermediate Similarity | NPC91573 |
0.8194 | Intermediate Similarity | NPC163597 |
0.8194 | Intermediate Similarity | NPC477602 |
0.8194 | Intermediate Similarity | NPC470145 |
0.8194 | Intermediate Similarity | NPC477601 |
0.8194 | Intermediate Similarity | NPC4209 |
0.8194 | Intermediate Similarity | NPC473916 |
0.8194 | Intermediate Similarity | NPC472487 |
0.8169 | Intermediate Similarity | NPC167702 |
0.8169 | Intermediate Similarity | NPC254509 |
0.8169 | Intermediate Similarity | NPC49168 |
0.8169 | Intermediate Similarity | NPC280026 |
0.8169 | Intermediate Similarity | NPC254340 |
0.8169 | Intermediate Similarity | NPC145552 |
0.8169 | Intermediate Similarity | NPC5046 |
0.8169 | Intermediate Similarity | NPC472503 |
0.8169 | Intermediate Similarity | NPC196358 |
0.8169 | Intermediate Similarity | NPC308440 |
0.8154 | Intermediate Similarity | NPC185547 |
0.8154 | Intermediate Similarity | NPC95804 |
0.8143 | Intermediate Similarity | NPC127283 |
0.8143 | Intermediate Similarity | NPC89310 |
0.8143 | Intermediate Similarity | NPC8004 |
0.8133 | Intermediate Similarity | NPC73515 |
0.8125 | Intermediate Similarity | NPC95958 |
0.8116 | Intermediate Similarity | NPC213178 |
0.8116 | Intermediate Similarity | NPC6120 |
0.8116 | Intermediate Similarity | NPC131892 |
0.8116 | Intermediate Similarity | NPC327728 |
0.8095 | Intermediate Similarity | NPC236588 |
0.8082 | Intermediate Similarity | NPC257191 |
0.8082 | Intermediate Similarity | NPC185915 |
0.8082 | Intermediate Similarity | NPC11907 |
0.8082 | Intermediate Similarity | NPC476233 |
0.8082 | Intermediate Similarity | NPC207010 |
0.8082 | Intermediate Similarity | NPC477227 |
0.8082 | Intermediate Similarity | NPC105208 |
0.8082 | Intermediate Similarity | NPC302578 |
0.8082 | Intermediate Similarity | NPC64081 |
0.8082 | Intermediate Similarity | NPC475031 |
0.8082 | Intermediate Similarity | NPC331618 |
0.8082 | Intermediate Similarity | NPC133596 |
0.8082 | Intermediate Similarity | NPC474574 |
0.8082 | Intermediate Similarity | NPC128951 |
0.8082 | Intermediate Similarity | NPC317913 |
0.8082 | Intermediate Similarity | NPC192046 |
0.806 | Intermediate Similarity | NPC477603 |
0.806 | Intermediate Similarity | NPC472946 |
0.8056 | Intermediate Similarity | NPC125767 |
0.8056 | Intermediate Similarity | NPC200243 |
0.8056 | Intermediate Similarity | NPC103822 |
0.8056 | Intermediate Similarity | NPC21220 |
0.8028 | Intermediate Similarity | NPC68426 |
0.8028 | Intermediate Similarity | NPC195489 |
0.8028 | Intermediate Similarity | NPC211009 |
0.8028 | Intermediate Similarity | NPC477229 |
0.8028 | Intermediate Similarity | NPC282905 |
0.8026 | Intermediate Similarity | NPC289486 |
0.8026 | Intermediate Similarity | NPC30583 |
0.8026 | Intermediate Similarity | NPC61107 |
0.8026 | Intermediate Similarity | NPC268040 |
0.8 | Intermediate Similarity | NPC261616 |
0.7973 | Intermediate Similarity | NPC31828 |
0.7973 | Intermediate Similarity | NPC18857 |
0.7973 | Intermediate Similarity | NPC477819 |
0.7973 | Intermediate Similarity | NPC171426 |
0.7973 | Intermediate Similarity | NPC244385 |
0.7973 | Intermediate Similarity | NPC34046 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC142712 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 |
---|---|---|---|
0.8939 | High Similarity | NPD4267 | Clinical (unspecified phase) |
0.8529 | High Similarity | NPD4787 | Phase 1 |
0.8406 | Intermediate Similarity | NPD4808 | Clinical (unspecified phase) |
0.8406 | Intermediate Similarity | NPD4809 | Clinical (unspecified phase) |
0.8194 | Intermediate Similarity | NPD6117 | Approved |
0.8169 | Intermediate Similarity | NPD6113 | Clinical (unspecified phase) |
0.8116 | Intermediate Similarity | NPD3699 | Clinical (unspecified phase) |
0.8116 | Intermediate Similarity | NPD3700 | Clinical (unspecified phase) |
0.8082 | Intermediate Similarity | NPD6116 | Phase 1 |
0.7973 | Intermediate Similarity | NPD6115 | Approved |
0.7973 | Intermediate Similarity | NPD6114 | Approved |
0.7973 | Intermediate Similarity | NPD6118 | Approved |
0.7973 | Intermediate Similarity | NPD6697 | Approved |
0.7808 | Intermediate Similarity | NPD3703 | Phase 2 |
0.7763 | Intermediate Similarity | NPD6928 | Phase 2 |
0.7763 | Intermediate Similarity | NPD7525 | Registered |
0.7746 | Intermediate Similarity | NPD4245 | Approved |
0.7746 | Intermediate Similarity | NPD4244 | Approved |
0.7746 | Intermediate Similarity | NPD4789 | Approved |
0.7722 | Intermediate Similarity | NPD7520 | Clinical (unspecified phase) |
0.7714 | Intermediate Similarity | NPD5360 | Phase 3 |
0.7714 | Intermediate Similarity | NPD5361 | Clinical (unspecified phase) |
0.7606 | Intermediate Similarity | NPD3698 | Phase 2 |
0.7536 | Intermediate Similarity | NPD3171 | Clinical (unspecified phase) |
0.7403 | Intermediate Similarity | NPD7645 | Phase 2 |
0.7333 | Intermediate Similarity | NPD6942 | Approved |
0.7333 | Intermediate Similarity | NPD7339 | Approved |
0.7273 | Intermediate Similarity | NPD3671 | Phase 1 |
0.7222 | Intermediate Similarity | NPD6705 | Phase 1 |
0.7162 | Intermediate Similarity | NPD4758 | Discontinued |
0.7049 | Intermediate Similarity | NPD385 | Approved |
0.7049 | Intermediate Similarity | NPD384 | Approved |
0.7013 | Intermediate Similarity | NPD3701 | Clinical (unspecified phase) |
0.6977 | Remote Similarity | NPD8034 | Phase 2 |
0.6977 | Remote Similarity | NPD8035 | Phase 2 |
0.6944 | Remote Similarity | NPD4224 | Phase 2 |
0.6933 | Remote Similarity | NPD6081 | Approved |
0.6875 | Remote Similarity | NPD4748 | Discontinued |
0.686 | Remote Similarity | NPD6700 | Approved |
0.686 | Remote Similarity | NPD6701 | Clinical (unspecified phase) |
0.6835 | Remote Similarity | NPD5364 | Discontinued |
0.6782 | Remote Similarity | NPD6702 | Approved |
0.6782 | Remote Similarity | NPD6703 | Approved |
0.6753 | Remote Similarity | NPD6924 | Approved |
0.6753 | Remote Similarity | NPD6926 | Approved |
0.6747 | Remote Similarity | NPD4786 | Approved |
0.6744 | Remote Similarity | NPD5328 | Approved |
0.6711 | Remote Similarity | NPD5777 | Approved |
0.6705 | Remote Similarity | NPD8171 | Discontinued |
0.6667 | Remote Similarity | NPD3702 | Approved |
0.6627 | Remote Similarity | NPD4788 | Approved |
0.6591 | Remote Similarity | NPD6079 | Approved |
0.6588 | Remote Similarity | NPD3618 | Phase 1 |
0.6582 | Remote Similarity | NPD6933 | Approved |
0.6506 | Remote Similarity | NPD3667 | Approved |
0.6494 | Remote Similarity | NPD7151 | Approved |
0.6494 | Remote Similarity | NPD4243 | Approved |
0.6494 | Remote Similarity | NPD7150 | Approved |
0.6494 | Remote Similarity | NPD7152 | Approved |
0.6447 | Remote Similarity | NPD6923 | Approved |
0.6447 | Remote Similarity | NPD6922 | Approved |
0.6413 | Remote Similarity | NPD7920 | Phase 3 |
0.6413 | Remote Similarity | NPD7919 | Phase 3 |
0.6404 | Remote Similarity | NPD7515 | Phase 2 |
0.6395 | Remote Similarity | NPD8308 | Discontinued |
0.6374 | Remote Similarity | NPD7991 | Discontinued |
0.6364 | Remote Similarity | NPD7143 | Approved |
0.6364 | Remote Similarity | NPD7144 | Approved |
0.6344 | Remote Similarity | NPD8088 | Phase 1 |
0.6341 | Remote Similarity | NPD6929 | Approved |
0.6333 | Remote Similarity | NPD4202 | Approved |
0.6329 | Remote Similarity | NPD4784 | Approved |
0.6329 | Remote Similarity | NPD4785 | Approved |
0.6322 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6277 | Remote Similarity | NPD8418 | Phase 2 |
0.6265 | Remote Similarity | NPD6930 | Phase 2 |
0.6265 | Remote Similarity | NPD7509 | Discontinued |
0.6265 | Remote Similarity | NPD6931 | Approved |
0.6216 | Remote Similarity | NPD371 | Approved |
0.617 | Remote Similarity | NPD7638 | Approved |
0.6163 | Remote Similarity | NPD3133 | Approved |
0.6163 | Remote Similarity | NPD3665 | Phase 1 |
0.6163 | Remote Similarity | NPD3666 | Approved |
0.6129 | Remote Similarity | NPD5221 | Approved |
0.6129 | Remote Similarity | NPD4697 | Phase 3 |
0.6129 | Remote Similarity | NPD5222 | Approved |
0.6129 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.6105 | Remote Similarity | NPD7639 | Approved |
0.6105 | Remote Similarity | NPD7640 | Approved |
0.6098 | Remote Similarity | NPD5776 | Phase 2 |
0.6098 | Remote Similarity | NPD6932 | Approved |
0.6098 | Remote Similarity | NPD6925 | Approved |
0.6094 | Remote Similarity | NPD388 | Approved |
0.6094 | Remote Similarity | NPD386 | Approved |
0.6087 | Remote Similarity | NPD7748 | Approved |
0.6064 | Remote Similarity | NPD4755 | Approved |
0.6064 | Remote Similarity | NPD5173 | Approved |
0.6049 | Remote Similarity | NPD4190 | Phase 3 |
0.6049 | Remote Similarity | NPD5275 | Approved |
0.6047 | Remote Similarity | NPD6695 | Phase 3 |
0.6024 | Remote Similarity | NPD7145 | Approved |
0.602 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.5979 | Remote Similarity | NPD7632 | Discontinued |
0.5978 | Remote Similarity | NPD6399 | Phase 3 |
0.5977 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.596 | Remote Similarity | NPD6920 | Discontinued |
0.5952 | Remote Similarity | NPD4195 | Approved |
0.5952 | Remote Similarity | NPD6683 | Phase 2 |
0.5938 | Remote Similarity | NPD5285 | Approved |
0.5938 | Remote Similarity | NPD4700 | Approved |
0.5938 | Remote Similarity | NPD5286 | Approved |
0.5938 | Remote Similarity | NPD4696 | Approved |
0.5909 | Remote Similarity | NPD6893 | Approved |
0.5895 | Remote Similarity | NPD7902 | Approved |
0.589 | Remote Similarity | NPD3198 | Approved |
0.5882 | Remote Similarity | NPD7514 | Phase 3 |
0.5876 | Remote Similarity | NPD5223 | Approved |
0.5843 | Remote Similarity | NPD5279 | Phase 3 |
0.5842 | Remote Similarity | NPD6415 | Discontinued |
0.5833 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD5290 | Discontinued |
0.5833 | Remote Similarity | NPD3617 | Approved |
0.5824 | Remote Similarity | NPD4753 | Phase 2 |
0.5816 | Remote Similarity | NPD5211 | Phase 2 |
0.5816 | Remote Similarity | NPD5225 | Approved |
0.5816 | Remote Similarity | NPD5226 | Approved |
0.5816 | Remote Similarity | NPD5224 | Approved |
0.5816 | Remote Similarity | NPD4633 | Approved |
0.5814 | Remote Similarity | NPD6902 | Approved |
0.58 | Remote Similarity | NPD5739 | Approved |
0.58 | Remote Similarity | NPD7128 | Approved |
0.58 | Remote Similarity | NPD6402 | Approved |
0.58 | Remote Similarity | NPD6675 | Approved |
0.5795 | Remote Similarity | NPD3668 | Phase 3 |
0.5778 | Remote Similarity | NPD7750 | Discontinued |
0.5778 | Remote Similarity | NPD7524 | Approved |
0.5758 | Remote Similarity | NPD4754 | Approved |
0.5758 | Remote Similarity | NPD5175 | Approved |
0.5758 | Remote Similarity | NPD5174 | Approved |
0.5747 | Remote Similarity | NPD4223 | Phase 3 |
0.5747 | Remote Similarity | NPD4221 | Approved |
0.5743 | Remote Similarity | NPD7646 | Clinical (unspecified phase) |
0.5732 | Remote Similarity | NPD1811 | Approved |
0.5732 | Remote Similarity | NPD1810 | Approved |
0.573 | Remote Similarity | NPD5329 | Approved |
0.5714 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4159 | Approved |
0.57 | Remote Similarity | NPD5141 | Approved |
0.5698 | Remote Similarity | NPD7332 | Phase 2 |
0.5694 | Remote Similarity | NPD586 | Phase 1 |
0.5686 | Remote Similarity | NPD6881 | Approved |
0.5686 | Remote Similarity | NPD7320 | Approved |
0.5686 | Remote Similarity | NPD6899 | Approved |
0.5667 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.5663 | Remote Similarity | NPD8264 | Approved |
0.5644 | Remote Similarity | NPD4767 | Approved |
0.5644 | Remote Similarity | NPD4768 | Approved |
0.5632 | Remote Similarity | NPD4692 | Approved |
0.5632 | Remote Similarity | NPD6898 | Phase 1 |
0.5632 | Remote Similarity | NPD4139 | Approved |
0.5631 | Remote Similarity | NPD6372 | Approved |
0.5631 | Remote Similarity | NPD6373 | Approved |
0.5618 | Remote Similarity | NPD4197 | Approved |
PubChem CID   | 76310266 |
ChEMBL   | CHEMBL3109387 |
ZINC   |
Molecular Weight:   | 430.38 |
ALogP:   | 1.3462 |
MLogP:   | 4.43 |
XLogP:   | 10.124 |
# Rotatable Bonds:   | 10 |
Polar Surface Area:   | 40.46 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 2 |
# Rings:   | 5 |
# Heavy Atoms:   | 31 |