Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 37.3 | % | 19006372 |
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 5.9 | % | PubChem BioAssay data set |
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 16.6 | % | DrugMatrix in vitro pharmacology data |
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 54.8 | % | 23822611 |
NPT993 | Cell Line | Hepatocyte | Mus musculus | IC50 | = | 70000 | nM | 2292684 |
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 NPC61503 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 |
---|---|---|
0.8438 | Intermediate Similarity | NPC473508 |
0.8333 | Intermediate Similarity | NPC311736 |
0.8308 | Intermediate Similarity | NPC300593 |
0.8209 | Intermediate Similarity | NPC163290 |
0.8182 | Intermediate Similarity | NPC471200 |
0.8125 | Intermediate Similarity | NPC99487 |
0.8028 | Intermediate Similarity | NPC190859 |
0.8 | Intermediate Similarity | NPC225342 |
0.7879 | Intermediate Similarity | NPC211291 |
0.7879 | Intermediate Similarity | NPC133368 |
0.7812 | Intermediate Similarity | NPC155025 |
0.7808 | Intermediate Similarity | NPC268111 |
0.7808 | Intermediate Similarity | NPC170148 |
0.7778 | Intermediate Similarity | NPC24443 |
0.7761 | Intermediate Similarity | NPC309300 |
0.7761 | Intermediate Similarity | NPC225415 |
0.7746 | Intermediate Similarity | NPC469343 |
0.7746 | Intermediate Similarity | NPC471662 |
0.7727 | Intermediate Similarity | NPC475251 |
0.7681 | Intermediate Similarity | NPC477791 |
0.7647 | Intermediate Similarity | NPC238352 |
0.7647 | Intermediate Similarity | NPC477009 |
0.7639 | Intermediate Similarity | NPC476709 |
0.7612 | Intermediate Similarity | NPC474155 |
0.7612 | Intermediate Similarity | NPC473759 |
0.7606 | Intermediate Similarity | NPC92801 |
0.7606 | Intermediate Similarity | NPC470041 |
0.7571 | Intermediate Similarity | NPC471238 |
0.7571 | Intermediate Similarity | NPC167527 |
0.7538 | Intermediate Similarity | NPC10017 |
0.7534 | Intermediate Similarity | NPC306727 |
0.75 | Intermediate Similarity | NPC290367 |
0.75 | Intermediate Similarity | NPC41886 |
0.75 | Intermediate Similarity | NPC164022 |
0.75 | Intermediate Similarity | NPC62755 |
0.7467 | Intermediate Similarity | NPC130136 |
0.7465 | Intermediate Similarity | NPC74722 |
0.7465 | Intermediate Similarity | NPC304690 |
0.7465 | Intermediate Similarity | NPC471560 |
0.7463 | Intermediate Similarity | NPC63111 |
0.7432 | Intermediate Similarity | NPC60818 |
0.7432 | Intermediate Similarity | NPC23231 |
0.7429 | Intermediate Similarity | NPC136813 |
0.7429 | Intermediate Similarity | NPC259299 |
0.7429 | Intermediate Similarity | NPC73603 |
0.7424 | Intermediate Similarity | NPC122239 |
0.7397 | Intermediate Similarity | NPC329763 |
0.7397 | Intermediate Similarity | NPC68443 |
0.7397 | Intermediate Similarity | NPC474140 |
0.7391 | Intermediate Similarity | NPC300442 |
0.7391 | Intermediate Similarity | NPC19569 |
0.7391 | Intermediate Similarity | NPC308844 |
0.7368 | Intermediate Similarity | NPC475980 |
0.7361 | Intermediate Similarity | NPC471781 |
0.7361 | Intermediate Similarity | NPC34834 |
0.7333 | Intermediate Similarity | NPC126969 |
0.7333 | Intermediate Similarity | NPC253190 |
0.7324 | Intermediate Similarity | NPC305698 |
0.7324 | Intermediate Similarity | NPC208999 |
0.7324 | Intermediate Similarity | NPC96484 |
0.7313 | Intermediate Similarity | NPC66020 |
0.7297 | Intermediate Similarity | NPC471659 |
0.7286 | Intermediate Similarity | NPC272125 |
0.7286 | Intermediate Similarity | NPC267027 |
0.7273 | Intermediate Similarity | NPC475830 |
0.7273 | Intermediate Similarity | NPC325869 |
0.7273 | Intermediate Similarity | NPC226848 |
0.726 | Intermediate Similarity | NPC477792 |
0.726 | Intermediate Similarity | NPC471272 |
0.726 | Intermediate Similarity | NPC242001 |
0.726 | Intermediate Similarity | NPC167706 |
0.7237 | Intermediate Similarity | NPC476007 |
0.7237 | Intermediate Similarity | NPC471454 |
0.7237 | Intermediate Similarity | NPC476703 |
0.7237 | Intermediate Similarity | NPC471798 |
0.7222 | Intermediate Similarity | NPC239373 |
0.7222 | Intermediate Similarity | NPC217570 |
0.7222 | Intermediate Similarity | NPC474248 |
0.7222 | Intermediate Similarity | NPC329989 |
0.7222 | Intermediate Similarity | NPC90115 |
0.7206 | Intermediate Similarity | NPC321867 |
0.7206 | Intermediate Similarity | NPC68679 |
0.7206 | Intermediate Similarity | NPC207007 |
0.72 | Intermediate Similarity | NPC319090 |
0.72 | Intermediate Similarity | NPC474885 |
0.72 | Intermediate Similarity | NPC291503 |
0.72 | Intermediate Similarity | NPC32832 |
0.72 | Intermediate Similarity | NPC328104 |
0.7188 | Intermediate Similarity | NPC286752 |
0.7183 | Intermediate Similarity | NPC82337 |
0.7183 | Intermediate Similarity | NPC69649 |
0.7183 | Intermediate Similarity | NPC68703 |
0.7183 | Intermediate Similarity | NPC114651 |
0.7183 | Intermediate Similarity | NPC253303 |
0.7183 | Intermediate Similarity | NPC472253 |
0.7183 | Intermediate Similarity | NPC269077 |
0.7183 | Intermediate Similarity | NPC472255 |
0.7183 | Intermediate Similarity | NPC476650 |
0.7179 | Intermediate Similarity | NPC96362 |
0.7179 | Intermediate Similarity | NPC287749 |
0.7164 | Intermediate Similarity | NPC475931 |
0.7164 | Intermediate Similarity | NPC5698 |
0.7162 | Intermediate Similarity | NPC471799 |
0.7162 | Intermediate Similarity | NPC310608 |
0.7162 | Intermediate Similarity | NPC234527 |
0.7162 | Intermediate Similarity | NPC14352 |
0.7143 | Intermediate Similarity | NPC11555 |
0.7143 | Intermediate Similarity | NPC60837 |
0.7143 | Intermediate Similarity | NPC477089 |
0.7143 | Intermediate Similarity | NPC205618 |
0.7143 | Intermediate Similarity | NPC87604 |
0.7143 | Intermediate Similarity | NPC469326 |
0.7143 | Intermediate Similarity | NPC172613 |
0.7143 | Intermediate Similarity | NPC282619 |
0.7143 | Intermediate Similarity | NPC261782 |
0.7143 | Intermediate Similarity | NPC2728 |
0.7143 | Intermediate Similarity | NPC208198 |
0.7125 | Intermediate Similarity | NPC231601 |
0.7125 | Intermediate Similarity | NPC113978 |
0.7123 | Intermediate Similarity | NPC254845 |
0.7123 | Intermediate Similarity | NPC145498 |
0.7105 | Intermediate Similarity | NPC1973 |
0.7105 | Intermediate Similarity | NPC477925 |
0.7105 | Intermediate Similarity | NPC167873 |
0.7105 | Intermediate Similarity | NPC471658 |
0.7105 | Intermediate Similarity | NPC274079 |
0.7101 | Intermediate Similarity | NPC279200 |
0.7101 | Intermediate Similarity | NPC83200 |
0.7101 | Intermediate Similarity | NPC50435 |
0.7089 | Intermediate Similarity | NPC471661 |
0.7089 | Intermediate Similarity | NPC476646 |
0.7083 | Intermediate Similarity | NPC245795 |
0.7067 | Intermediate Similarity | NPC329090 |
0.7067 | Intermediate Similarity | NPC91858 |
0.7067 | Intermediate Similarity | NPC243342 |
0.7067 | Intermediate Similarity | NPC477138 |
0.7067 | Intermediate Similarity | NPC471797 |
0.7067 | Intermediate Similarity | NPC27395 |
0.7059 | Intermediate Similarity | NPC323153 |
0.7059 | Intermediate Similarity | NPC240506 |
0.7059 | Intermediate Similarity | NPC135648 |
0.7051 | Intermediate Similarity | NPC472463 |
0.7051 | Intermediate Similarity | NPC86971 |
0.7042 | Intermediate Similarity | NPC162309 |
0.7042 | Intermediate Similarity | NPC202017 |
0.7042 | Intermediate Similarity | NPC326310 |
0.7042 | Intermediate Similarity | NPC149680 |
0.7027 | Intermediate Similarity | NPC23954 |
0.7027 | Intermediate Similarity | NPC471271 |
0.7027 | Intermediate Similarity | NPC471268 |
0.7013 | Intermediate Similarity | NPC34019 |
0.7013 | Intermediate Similarity | NPC31037 |
0.7 | Intermediate Similarity | NPC287744 |
0.7 | Intermediate Similarity | NPC470614 |
0.7 | Intermediate Similarity | NPC210560 |
0.7 | Intermediate Similarity | NPC101128 |
0.7 | Intermediate Similarity | NPC1272 |
0.7 | Intermediate Similarity | NPC24824 |
0.7 | Intermediate Similarity | NPC219940 |
0.7 | Intermediate Similarity | NPC140233 |
0.7 | Intermediate Similarity | NPC96793 |
0.7 | Intermediate Similarity | NPC144650 |
0.7 | Intermediate Similarity | NPC87439 |
0.7 | Intermediate Similarity | NPC107540 |
0.7 | Intermediate Similarity | NPC323424 |
0.7 | Intermediate Similarity | NPC165651 |
0.7 | Intermediate Similarity | NPC110241 |
0.6986 | Remote Similarity | NPC473893 |
0.6986 | Remote Similarity | NPC144647 |
0.6986 | Remote Similarity | NPC16964 |
0.6974 | Remote Similarity | NPC133580 |
0.6974 | Remote Similarity | NPC66566 |
0.6974 | Remote Similarity | NPC477923 |
0.6974 | Remote Similarity | NPC113639 |
0.6974 | Remote Similarity | NPC114236 |
0.6974 | Remote Similarity | NPC313185 |
0.6974 | Remote Similarity | NPC93213 |
0.697 | Remote Similarity | NPC48891 |
0.6962 | Remote Similarity | NPC324772 |
0.6962 | Remote Similarity | NPC26117 |
0.6962 | Remote Similarity | NPC471266 |
0.6962 | Remote Similarity | NPC95124 |
0.6957 | Remote Similarity | NPC274704 |
0.6944 | Remote Similarity | NPC96962 |
0.6944 | Remote Similarity | NPC161612 |
0.6944 | Remote Similarity | NPC139207 |
0.6944 | Remote Similarity | NPC197805 |
0.6944 | Remote Similarity | NPC171225 |
0.6944 | Remote Similarity | NPC185874 |
0.6944 | Remote Similarity | NPC33583 |
0.6933 | Remote Similarity | NPC275098 |
0.6933 | Remote Similarity | NPC130665 |
0.6933 | Remote Similarity | NPC95165 |
0.6933 | Remote Similarity | NPC182717 |
0.6923 | Remote Similarity | NPC138621 |
0.6923 | Remote Similarity | NPC476314 |
0.6923 | Remote Similarity | NPC167037 |
0.6923 | Remote Similarity | NPC244385 |
0.6923 | Remote Similarity | NPC6978 |
0.6923 | Remote Similarity | NPC302041 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC61503 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 |
---|---|---|---|
0.7206 | Intermediate Similarity | NPD368 | Approved |
0.7067 | Intermediate Similarity | NPD6924 | Approved |
0.7067 | Intermediate Similarity | NPD6926 | Approved |
0.7051 | Intermediate Similarity | NPD6929 | Approved |
0.6962 | Remote Similarity | NPD6931 | Approved |
0.6962 | Remote Similarity | NPD6930 | Phase 2 |
0.6883 | Remote Similarity | NPD6933 | Approved |
0.6883 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6875 | Remote Similarity | NPD6902 | Approved |
0.6829 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6818 | Remote Similarity | NPD342 | Phase 1 |
0.6795 | Remote Similarity | NPD6932 | Approved |
0.6795 | Remote Similarity | NPD5776 | Phase 2 |
0.6795 | Remote Similarity | NPD6925 | Approved |
0.6757 | Remote Similarity | NPD6922 | Approved |
0.6757 | Remote Similarity | NPD6923 | Approved |
0.6753 | Remote Similarity | NPD7339 | Approved |
0.6753 | Remote Similarity | NPD6942 | Approved |
0.675 | Remote Similarity | NPD7525 | Registered |
0.675 | Remote Similarity | NPD7509 | Discontinued |
0.6709 | Remote Similarity | NPD7145 | Approved |
0.6707 | Remote Similarity | NPD6695 | Phase 3 |
0.6667 | Remote Similarity | NPD7144 | Approved |
0.6667 | Remote Similarity | NPD7143 | Approved |
0.6625 | Remote Similarity | NPD7645 | Phase 2 |
0.6625 | Remote Similarity | NPD6683 | Phase 2 |
0.6579 | Remote Similarity | NPD7150 | Approved |
0.6579 | Remote Similarity | NPD7151 | Approved |
0.6579 | Remote Similarity | NPD7152 | Approved |
0.6548 | Remote Similarity | NPD6893 | Approved |
0.6543 | Remote Similarity | NPD7332 | Phase 2 |
0.6543 | Remote Similarity | NPD7514 | Phase 3 |
0.6538 | Remote Similarity | NPD8264 | Approved |
0.6463 | Remote Similarity | NPD6898 | Phase 1 |
0.6395 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6395 | Remote Similarity | NPD7750 | Discontinued |
0.6395 | Remote Similarity | NPD7524 | Approved |
0.6386 | Remote Similarity | NPD3667 | Approved |
0.6296 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.6282 | Remote Similarity | NPD4732 | Discontinued |
0.6235 | Remote Similarity | NPD3665 | Phase 1 |
0.6235 | Remote Similarity | NPD3666 | Approved |
0.6235 | Remote Similarity | NPD3133 | Approved |
0.6235 | Remote Similarity | NPD4786 | Approved |
0.6154 | Remote Similarity | NPD4243 | Approved |
0.6111 | Remote Similarity | NPD7087 | Discontinued |
0.6098 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6092 | Remote Similarity | NPD5279 | Phase 3 |
0.6092 | Remote Similarity | NPD3618 | Phase 1 |
0.6 | Remote Similarity | NPD4784 | Approved |
0.6 | Remote Similarity | NPD4219 | Approved |
0.6 | Remote Similarity | NPD4785 | Approved |
0.6 | Remote Similarity | NPD7838 | Discovery |
0.5978 | Remote Similarity | NPD5282 | Discontinued |
0.5952 | Remote Similarity | NPD4822 | Approved |
0.5952 | Remote Similarity | NPD5368 | Approved |
0.5952 | Remote Similarity | NPD4748 | Discontinued |
0.5952 | Remote Similarity | NPD4820 | Approved |
0.5952 | Remote Similarity | NPD4821 | Approved |
0.5952 | Remote Similarity | NPD4819 | Approved |
0.5926 | Remote Similarity | NPD4190 | Phase 3 |
0.5926 | Remote Similarity | NPD5275 | Approved |
0.5904 | Remote Similarity | NPD4271 | Approved |
0.5904 | Remote Similarity | NPD4268 | Approved |
0.5889 | Remote Similarity | NPD5328 | Approved |
0.587 | Remote Similarity | NPD4202 | Approved |
0.5846 | Remote Similarity | NPD385 | Approved |
0.5846 | Remote Similarity | NPD384 | Approved |
0.5833 | Remote Similarity | NPD4195 | Approved |
0.5824 | Remote Similarity | NPD46 | Approved |
0.5824 | Remote Similarity | NPD7136 | Phase 2 |
0.5824 | Remote Similarity | NPD6698 | Approved |
0.5824 | Remote Similarity | NPD3168 | Discontinued |
0.5814 | Remote Similarity | NPD6435 | Approved |
0.5795 | Remote Similarity | NPD1696 | Phase 3 |
0.5795 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.5765 | Remote Similarity | NPD4695 | Discontinued |
0.5765 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5761 | Remote Similarity | NPD6411 | Approved |
0.5761 | Remote Similarity | NPD6079 | Approved |
0.5761 | Remote Similarity | NPD7515 | Phase 2 |
0.5761 | Remote Similarity | NPD7637 | Suspended |
0.5747 | Remote Similarity | NPD5362 | Discontinued |
0.5747 | Remote Similarity | NPD5331 | Approved |
0.5747 | Remote Similarity | NPD5332 | Approved |
0.5745 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.573 | Remote Similarity | NPD4249 | Approved |
0.5729 | Remote Similarity | NPD7638 | Approved |
0.5714 | Remote Similarity | NPD7331 | Phase 2 |
0.5714 | Remote Similarity | NPD4753 | Phase 2 |
0.5699 | Remote Similarity | NPD6399 | Phase 3 |
0.5699 | Remote Similarity | NPD5779 | Approved |
0.5699 | Remote Similarity | NPD5778 | Approved |
0.5698 | Remote Similarity | NPD4790 | Discontinued |
0.5698 | Remote Similarity | NPD5369 | Approved |
0.5696 | Remote Similarity | NPD15 | Approved |
0.5696 | Remote Similarity | NPD1082 | Approved |
0.5696 | Remote Similarity | NPD791 | Approved |
0.5692 | Remote Similarity | NPD4265 | Approved |
0.5692 | Remote Similarity | NPD388 | Approved |
0.5692 | Remote Similarity | NPD386 | Approved |
0.5682 | Remote Similarity | NPD3668 | Phase 3 |
0.567 | Remote Similarity | NPD7640 | Approved |
0.567 | Remote Similarity | NPD7639 | Approved |
0.5667 | Remote Similarity | NPD4250 | Approved |
0.5667 | Remote Similarity | NPD4251 | Approved |
0.5663 | Remote Similarity | NPD1346 | Approved |
0.5632 | Remote Similarity | NPD4221 | Approved |
0.5632 | Remote Similarity | NPD4269 | Approved |
0.5632 | Remote Similarity | NPD4223 | Phase 3 |
0.5632 | Remote Similarity | NPD4270 | Approved |
0.5631 | Remote Similarity | NPD6371 | Approved |
0.5625 | Remote Similarity | NPD4755 | Approved |
0.5618 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.5612 | Remote Similarity | NPD5344 | Discontinued |
PubChem CID   | 10331790 |
ChEMBL   | CHEMBL450757 |
ZINC   |
Molecular Weight:   | 238.19 |
ALogP:   | 1.1899 |
MLogP:   | 2.89 |
XLogP:   | 2.471 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 40.46 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 2 |
# Rings:   | 2 |
# Heavy Atoms:   | 17 |