Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT397 | Cell Line | NCI-H460 | Homo sapiens | IC50 | > | 10000 | nM | 19075050 |
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 NPC472946 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 |
---|---|---|
0.9077 | High Similarity | NPC107919 |
0.9077 | High Similarity | NPC99264 |
0.8824 | High Similarity | NPC472945 |
0.8824 | High Similarity | NPC472944 |
0.875 | High Similarity | NPC243469 |
0.875 | High Similarity | NPC190827 |
0.875 | High Similarity | NPC475943 |
0.8696 | High Similarity | NPC317242 |
0.8696 | High Similarity | NPC158208 |
0.8696 | High Similarity | NPC243027 |
0.8696 | High Similarity | NPC196136 |
0.8571 | High Similarity | NPC163597 |
0.8551 | High Similarity | NPC192501 |
0.8551 | High Similarity | NPC10476 |
0.8551 | High Similarity | NPC228994 |
0.8529 | High Similarity | NPC131506 |
0.8529 | High Similarity | NPC157777 |
0.8507 | High Similarity | NPC299948 |
0.8507 | High Similarity | NPC241085 |
0.8507 | High Similarity | NPC66407 |
0.8507 | High Similarity | NPC470830 |
0.8485 | Intermediate Similarity | NPC63190 |
0.8451 | Intermediate Similarity | NPC105208 |
0.8451 | Intermediate Similarity | NPC185915 |
0.8451 | Intermediate Similarity | NPC192046 |
0.8451 | Intermediate Similarity | NPC128951 |
0.8451 | Intermediate Similarity | NPC477227 |
0.8451 | Intermediate Similarity | NPC302578 |
0.8438 | Intermediate Similarity | NPC114891 |
0.8406 | Intermediate Similarity | NPC153719 |
0.8406 | Intermediate Similarity | NPC470610 |
0.8387 | Intermediate Similarity | NPC476735 |
0.8382 | Intermediate Similarity | NPC231945 |
0.8358 | Intermediate Similarity | NPC472741 |
0.8333 | Intermediate Similarity | NPC147993 |
0.8333 | Intermediate Similarity | NPC67657 |
0.8333 | Intermediate Similarity | NPC18857 |
0.8286 | Intermediate Similarity | NPC304499 |
0.8286 | Intermediate Similarity | NPC48795 |
0.8281 | Intermediate Similarity | NPC148174 |
0.8281 | Intermediate Similarity | NPC218585 |
0.8281 | Intermediate Similarity | NPC71460 |
0.8261 | Intermediate Similarity | NPC1340 |
0.8261 | Intermediate Similarity | NPC187471 |
0.8261 | Intermediate Similarity | NPC157422 |
0.8261 | Intermediate Similarity | NPC127094 |
0.8261 | Intermediate Similarity | NPC109457 |
0.8261 | Intermediate Similarity | NPC470071 |
0.8261 | Intermediate Similarity | NPC252182 |
0.8261 | Intermediate Similarity | NPC100586 |
0.8235 | Intermediate Similarity | NPC470833 |
0.8219 | Intermediate Similarity | NPC269333 |
0.8219 | Intermediate Similarity | NPC287452 |
0.8219 | Intermediate Similarity | NPC81074 |
0.8219 | Intermediate Similarity | NPC477282 |
0.8209 | Intermediate Similarity | NPC48079 |
0.8209 | Intermediate Similarity | NPC473230 |
0.8209 | Intermediate Similarity | NPC475884 |
0.8194 | Intermediate Similarity | NPC64081 |
0.8194 | Intermediate Similarity | NPC133596 |
0.8194 | Intermediate Similarity | NPC264602 |
0.8194 | Intermediate Similarity | NPC474574 |
0.8194 | Intermediate Similarity | NPC11907 |
0.8169 | Intermediate Similarity | NPC131584 |
0.8169 | Intermediate Similarity | NPC139765 |
0.8143 | Intermediate Similarity | NPC473238 |
0.8143 | Intermediate Similarity | NPC472341 |
0.8116 | Intermediate Similarity | NPC251201 |
0.8116 | Intermediate Similarity | NPC63588 |
0.8116 | Intermediate Similarity | NPC232925 |
0.8116 | Intermediate Similarity | NPC192192 |
0.8116 | Intermediate Similarity | NPC282454 |
0.8088 | Intermediate Similarity | NPC474756 |
0.806 | Intermediate Similarity | NPC142712 |
0.806 | Intermediate Similarity | NPC44122 |
0.8056 | Intermediate Similarity | NPC470145 |
0.803 | Intermediate Similarity | NPC167995 |
0.803 | Intermediate Similarity | NPC281540 |
0.803 | Intermediate Similarity | NPC159654 |
0.803 | Intermediate Similarity | NPC69149 |
0.803 | Intermediate Similarity | NPC118937 |
0.8028 | Intermediate Similarity | NPC475458 |
0.8 | Intermediate Similarity | NPC8004 |
0.8 | Intermediate Similarity | NPC95804 |
0.8 | Intermediate Similarity | NPC127283 |
0.8 | Intermediate Similarity | NPC185547 |
0.8 | Intermediate Similarity | NPC478103 |
0.7971 | Intermediate Similarity | NPC254037 |
0.7971 | Intermediate Similarity | NPC477820 |
0.7971 | Intermediate Similarity | NPC129829 |
0.7937 | Intermediate Similarity | NPC236588 |
0.7937 | Intermediate Similarity | NPC135438 |
0.7917 | Intermediate Similarity | NPC472952 |
0.7917 | Intermediate Similarity | NPC91387 |
0.7917 | Intermediate Similarity | NPC231680 |
0.7917 | Intermediate Similarity | NPC472950 |
0.7917 | Intermediate Similarity | NPC270306 |
0.791 | Intermediate Similarity | NPC260116 |
0.791 | Intermediate Similarity | NPC41577 |
0.791 | Intermediate Similarity | NPC474380 |
0.791 | Intermediate Similarity | NPC473276 |
0.7895 | Intermediate Similarity | NPC154043 |
0.7895 | Intermediate Similarity | NPC475388 |
0.7895 | Intermediate Similarity | NPC60018 |
0.7895 | Intermediate Similarity | NPC202688 |
0.7879 | Intermediate Similarity | NPC236099 |
0.7879 | Intermediate Similarity | NPC209686 |
0.7879 | Intermediate Similarity | NPC249078 |
0.7867 | Intermediate Similarity | NPC16449 |
0.7812 | Intermediate Similarity | NPC162685 |
0.7812 | Intermediate Similarity | NPC47663 |
0.7808 | Intermediate Similarity | NPC91573 |
0.7808 | Intermediate Similarity | NPC477601 |
0.7808 | Intermediate Similarity | NPC473916 |
0.7808 | Intermediate Similarity | NPC477602 |
0.7792 | Intermediate Similarity | NPC85095 |
0.7792 | Intermediate Similarity | NPC216420 |
0.7792 | Intermediate Similarity | NPC472744 |
0.7792 | Intermediate Similarity | NPC211135 |
0.7792 | Intermediate Similarity | NPC478054 |
0.7778 | Intermediate Similarity | NPC478130 |
0.7778 | Intermediate Similarity | NPC472854 |
0.7746 | Intermediate Similarity | NPC195530 |
0.7746 | Intermediate Similarity | NPC473279 |
0.7703 | Intermediate Similarity | NPC476233 |
0.7703 | Intermediate Similarity | NPC477919 |
0.7703 | Intermediate Similarity | NPC171658 |
0.7703 | Intermediate Similarity | NPC180199 |
0.7692 | Intermediate Similarity | NPC320824 |
0.7692 | Intermediate Similarity | NPC95958 |
0.7671 | Intermediate Similarity | NPC3403 |
0.7671 | Intermediate Similarity | NPC24014 |
0.7671 | Intermediate Similarity | NPC27349 |
0.7662 | Intermediate Similarity | NPC317066 |
0.7662 | Intermediate Similarity | NPC30166 |
0.7632 | Intermediate Similarity | NPC117137 |
0.7632 | Intermediate Similarity | NPC66766 |
0.76 | Intermediate Similarity | NPC471045 |
0.76 | Intermediate Similarity | NPC199965 |
0.76 | Intermediate Similarity | NPC476732 |
0.76 | Intermediate Similarity | NPC301707 |
0.76 | Intermediate Similarity | NPC471769 |
0.7595 | Intermediate Similarity | NPC290612 |
0.7595 | Intermediate Similarity | NPC266651 |
0.7571 | Intermediate Similarity | NPC475893 |
0.7564 | Intermediate Similarity | NPC207013 |
0.7564 | Intermediate Similarity | NPC470070 |
0.7564 | Intermediate Similarity | NPC477285 |
0.7564 | Intermediate Similarity | NPC111582 |
0.7534 | Intermediate Similarity | NPC470151 |
0.7534 | Intermediate Similarity | NPC477508 |
0.7532 | Intermediate Similarity | NPC12933 |
0.75 | Intermediate Similarity | NPC151018 |
0.75 | Intermediate Similarity | NPC472745 |
0.75 | Intermediate Similarity | NPC328714 |
0.75 | Intermediate Similarity | NPC121981 |
0.75 | Intermediate Similarity | NPC155531 |
0.75 | Intermediate Similarity | NPC215968 |
0.75 | Intermediate Similarity | NPC320549 |
0.75 | Intermediate Similarity | NPC156277 |
0.75 | Intermediate Similarity | NPC3025 |
0.75 | Intermediate Similarity | NPC94897 |
0.75 | Intermediate Similarity | NPC58057 |
0.7468 | Intermediate Similarity | NPC474156 |
0.7468 | Intermediate Similarity | NPC255882 |
0.7467 | Intermediate Similarity | NPC207010 |
0.7467 | Intermediate Similarity | NPC475031 |
0.7467 | Intermediate Similarity | NPC317913 |
0.7436 | Intermediate Similarity | NPC477286 |
0.7436 | Intermediate Similarity | NPC164289 |
0.7436 | Intermediate Similarity | NPC286719 |
0.7436 | Intermediate Similarity | NPC121121 |
0.7436 | Intermediate Similarity | NPC242771 |
0.7436 | Intermediate Similarity | NPC311642 |
0.7436 | Intermediate Similarity | NPC477935 |
0.7436 | Intermediate Similarity | NPC100366 |
0.7429 | Intermediate Similarity | NPC476928 |
0.7429 | Intermediate Similarity | NPC204233 |
0.7429 | Intermediate Similarity | NPC475172 |
0.7407 | Intermediate Similarity | NPC140446 |
0.7407 | Intermediate Similarity | NPC202937 |
0.7407 | Intermediate Similarity | NPC5943 |
0.7407 | Intermediate Similarity | NPC263802 |
0.7407 | Intermediate Similarity | NPC43912 |
0.7407 | Intermediate Similarity | NPC210658 |
0.7407 | Intermediate Similarity | NPC161928 |
0.7403 | Intermediate Similarity | NPC22403 |
0.7403 | Intermediate Similarity | NPC236237 |
0.7403 | Intermediate Similarity | NPC322313 |
0.7403 | Intermediate Similarity | NPC470609 |
0.7403 | Intermediate Similarity | NPC102253 |
0.7403 | Intermediate Similarity | NPC472943 |
0.7403 | Intermediate Similarity | NPC472951 |
0.7403 | Intermediate Similarity | NPC474714 |
0.7403 | Intermediate Similarity | NPC13554 |
0.7397 | Intermediate Similarity | NPC232112 |
0.7397 | Intermediate Similarity | NPC474140 |
0.7397 | Intermediate Similarity | NPC253805 |
0.7397 | Intermediate Similarity | NPC310766 |
0.7391 | Intermediate Similarity | NPC80463 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC472946 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 |
---|---|---|---|
0.9077 | High Similarity | NPD4267 | Clinical (unspecified phase) |
0.7857 | Intermediate Similarity | NPD4787 | Phase 1 |
0.7647 | Intermediate Similarity | NPD3171 | Clinical (unspecified phase) |
0.75 | Intermediate Similarity | NPD4809 | Clinical (unspecified phase) |
0.75 | Intermediate Similarity | NPD4808 | Clinical (unspecified phase) |
0.7467 | Intermediate Similarity | NPD6116 | Phase 1 |
0.7403 | Intermediate Similarity | NPD7525 | Registered |
0.7361 | Intermediate Similarity | NPD4244 | Approved |
0.7361 | Intermediate Similarity | NPD4245 | Approved |
0.7361 | Intermediate Similarity | NPD4789 | Approved |
0.7333 | Intermediate Similarity | NPD6933 | Approved |
0.7333 | Intermediate Similarity | NPD6117 | Approved |
0.7324 | Intermediate Similarity | NPD6705 | Phase 1 |
0.7297 | Intermediate Similarity | NPD6113 | Clinical (unspecified phase) |
0.7222 | Intermediate Similarity | NPD3699 | Clinical (unspecified phase) |
0.7222 | Intermediate Similarity | NPD3698 | Phase 2 |
0.7222 | Intermediate Similarity | NPD3700 | Clinical (unspecified phase) |
0.7143 | Intermediate Similarity | NPD6115 | Approved |
0.7143 | Intermediate Similarity | NPD6118 | Approved |
0.7143 | Intermediate Similarity | NPD6114 | Approved |
0.7143 | Intermediate Similarity | NPD6697 | Approved |
0.7083 | Intermediate Similarity | NPD5361 | Clinical (unspecified phase) |
0.7083 | Intermediate Similarity | NPD5360 | Phase 3 |
0.7067 | Intermediate Similarity | NPD6924 | Approved |
0.7067 | Intermediate Similarity | NPD6926 | Approved |
0.6974 | Remote Similarity | NPD6942 | Approved |
0.6974 | Remote Similarity | NPD7339 | Approved |
0.6962 | Remote Similarity | NPD6928 | Phase 2 |
0.6829 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.68 | Remote Similarity | NPD6081 | Approved |
0.6786 | Remote Similarity | NPD7524 | Approved |
0.6782 | Remote Similarity | NPD8171 | Discontinued |
0.6761 | Remote Similarity | NPD371 | Approved |
0.6753 | Remote Similarity | NPD3703 | Phase 2 |
0.6753 | Remote Similarity | NPD3702 | Approved |
0.675 | Remote Similarity | NPD6931 | Approved |
0.675 | Remote Similarity | NPD6930 | Phase 2 |
0.6707 | Remote Similarity | NPD6695 | Phase 3 |
0.6667 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6625 | Remote Similarity | NPD6929 | Approved |
0.6613 | Remote Similarity | NPD385 | Approved |
0.6613 | Remote Similarity | NPD384 | Approved |
0.6582 | Remote Similarity | NPD6932 | Approved |
0.6579 | Remote Similarity | NPD4243 | Approved |
0.6579 | Remote Similarity | NPD4758 | Discontinued |
0.6575 | Remote Similarity | NPD4224 | Phase 2 |
0.6543 | Remote Similarity | NPD7509 | Discontinued |
0.6543 | Remote Similarity | NPD4748 | Discontinued |
0.6533 | Remote Similarity | NPD6923 | Approved |
0.6533 | Remote Similarity | NPD6922 | Approved |
0.6506 | Remote Similarity | NPD4788 | Approved |
0.65 | Remote Similarity | NPD3671 | Phase 1 |
0.65 | Remote Similarity | NPD5364 | Discontinued |
0.6447 | Remote Similarity | NPD7143 | Approved |
0.6447 | Remote Similarity | NPD7144 | Approved |
0.6429 | Remote Similarity | NPD4786 | Approved |
0.642 | Remote Similarity | NPD6683 | Phase 2 |
0.641 | Remote Similarity | NPD4784 | Approved |
0.641 | Remote Similarity | NPD4785 | Approved |
0.6395 | Remote Similarity | NPD7750 | Discontinued |
0.6375 | Remote Similarity | NPD6925 | Approved |
0.6375 | Remote Similarity | NPD5776 | Phase 2 |
0.6364 | Remote Similarity | NPD7150 | Approved |
0.6364 | Remote Similarity | NPD7151 | Approved |
0.6364 | Remote Similarity | NPD5777 | Approved |
0.6364 | Remote Similarity | NPD7152 | Approved |
0.6353 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.6353 | Remote Similarity | NPD6893 | Approved |
0.6341 | Remote Similarity | NPD7514 | Phase 3 |
0.6296 | Remote Similarity | NPD7145 | Approved |
0.625 | Remote Similarity | NPD4753 | Phase 2 |
0.622 | Remote Similarity | NPD7645 | Phase 2 |
0.6207 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.619 | Remote Similarity | NPD3667 | Approved |
0.619 | Remote Similarity | NPD388 | Approved |
0.619 | Remote Similarity | NPD386 | Approved |
0.618 | Remote Similarity | NPD6701 | Clinical (unspecified phase) |
0.618 | Remote Similarity | NPD6700 | Approved |
0.6145 | Remote Similarity | NPD7332 | Phase 2 |
0.6129 | Remote Similarity | NPD4755 | Approved |
0.6125 | Remote Similarity | NPD4190 | Phase 3 |
0.6125 | Remote Similarity | NPD5275 | Approved |
0.6111 | Remote Similarity | NPD6703 | Approved |
0.6111 | Remote Similarity | NPD7087 | Discontinued |
0.6111 | Remote Similarity | NPD8035 | Phase 2 |
0.6111 | Remote Similarity | NPD6702 | Approved |
0.6111 | Remote Similarity | NPD8034 | Phase 2 |
0.6098 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.6082 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.6071 | Remote Similarity | NPD6902 | Approved |
0.6071 | Remote Similarity | NPD6898 | Phase 1 |
0.6067 | Remote Similarity | NPD5328 | Approved |
0.6047 | Remote Similarity | NPD3665 | Phase 1 |
0.6047 | Remote Similarity | NPD3133 | Approved |
0.6047 | Remote Similarity | NPD3666 | Approved |
0.6044 | Remote Similarity | NPD4202 | Approved |
0.6044 | Remote Similarity | NPD6399 | Phase 3 |
0.6024 | Remote Similarity | NPD4195 | Approved |
0.6 | Remote Similarity | NPD5286 | Approved |
0.6 | Remote Similarity | NPD1811 | Approved |
0.6 | Remote Similarity | NPD4696 | Approved |
0.6 | Remote Similarity | NPD4700 | Approved |
0.6 | Remote Similarity | NPD5285 | Approved |
0.6 | Remote Similarity | NPD1810 | Approved |
0.5972 | Remote Similarity | NPD3198 | Approved |
0.5957 | Remote Similarity | NPD6084 | Phase 2 |
0.5957 | Remote Similarity | NPD6083 | Phase 2 |
0.5934 | Remote Similarity | NPD6079 | Approved |
0.5914 | Remote Similarity | NPD5210 | Approved |
0.5914 | Remote Similarity | NPD4629 | Approved |
0.5914 | Remote Similarity | NPD7991 | Discontinued |
0.5909 | Remote Similarity | NPD3618 | Phase 1 |
0.5876 | Remote Similarity | NPD5225 | Approved |
0.5876 | Remote Similarity | NPD4633 | Approved |
0.5876 | Remote Similarity | NPD5224 | Approved |
0.5876 | Remote Similarity | NPD5211 | Phase 2 |
0.5876 | Remote Similarity | NPD5226 | Approved |
0.5859 | Remote Similarity | NPD5739 | Approved |
0.5859 | Remote Similarity | NPD6402 | Approved |
0.5859 | Remote Similarity | NPD7128 | Approved |
0.5859 | Remote Similarity | NPD6675 | Approved |
0.5823 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.5816 | Remote Similarity | NPD5174 | Approved |
0.5816 | Remote Similarity | NPD5175 | Approved |
0.5814 | Remote Similarity | NPD4221 | Approved |
0.5814 | Remote Similarity | NPD4223 | Phase 3 |
0.58 | Remote Similarity | NPD6412 | Phase 2 |
0.5795 | Remote Similarity | NPD5329 | Approved |
0.5789 | Remote Similarity | NPD7919 | Phase 3 |
0.5789 | Remote Similarity | NPD7920 | Phase 3 |
0.5784 | Remote Similarity | NPD4634 | Approved |
0.5773 | Remote Similarity | NPD5223 | Approved |
0.5773 | Remote Similarity | NPD4159 | Approved |
0.5758 | Remote Similarity | NPD5141 | Approved |
0.575 | Remote Similarity | NPD3187 | Discontinued |
0.5743 | Remote Similarity | NPD8174 | Phase 2 |
0.5743 | Remote Similarity | NPD7320 | Approved |
0.5743 | Remote Similarity | NPD6899 | Approved |
0.5743 | Remote Similarity | NPD6881 | Approved |
0.573 | Remote Similarity | NPD5279 | Phase 3 |
0.5729 | Remote Similarity | NPD8088 | Phase 1 |
0.5714 | Remote Similarity | NPD6051 | Approved |
0.5714 | Remote Similarity | NPD3617 | Approved |
0.5714 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.57 | Remote Similarity | NPD4768 | Approved |
0.57 | Remote Similarity | NPD4767 | Approved |
0.5698 | Remote Similarity | NPD4139 | Approved |
0.5698 | Remote Similarity | NPD4692 | Approved |
0.5686 | Remote Similarity | NPD6373 | Approved |
0.5686 | Remote Similarity | NPD6372 | Approved |
0.5684 | Remote Similarity | NPD4697 | Phase 3 |
0.5684 | Remote Similarity | NPD5221 | Approved |
0.5684 | Remote Similarity | NPD5222 | Approved |
0.5684 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.5682 | Remote Similarity | NPD4197 | Approved |
0.5682 | Remote Similarity | NPD3668 | Phase 3 |
0.5673 | Remote Similarity | NPD8297 | Approved |
0.567 | Remote Similarity | NPD8418 | Phase 2 |
0.5658 | Remote Similarity | NPD7909 | Approved |
0.5657 | Remote Similarity | NPD4754 | Approved |
0.5644 | Remote Similarity | NPD5697 | Approved |
0.5644 | Remote Similarity | NPD5701 | Approved |
0.5631 | Remote Similarity | NPD7102 | Approved |
0.5631 | Remote Similarity | NPD6883 | Approved |
0.5631 | Remote Similarity | NPD7290 | Approved |
0.5625 | Remote Similarity | NPD2687 | Approved |
0.5625 | Remote Similarity | NPD5173 | Approved |
0.5625 | Remote Similarity | NPD2254 | Approved |
0.5625 | Remote Similarity | NPD2686 | Approved |
0.5619 | Remote Similarity | NPD8133 | Approved |
PubChem CID   | |
ChEMBL   | CHEMBL3594166 |
ZINC   |
Molecular Weight:   | 354.28 |
ALogP:   | -0.7242 |
MLogP:   | 3.33 |
XLogP:   | 5.272 |
# Rotatable Bonds:   | 12 |
Polar Surface Area:   | 80.92 |
# H-Bond Aceptor:   | 4 |
# H-Bond Donor:   | 4 |
# Rings:   | 3 |
# Heavy Atoms:   | 25 |