Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 9.5 | % | 26331426 |
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 16.5 | % | 26331426 |
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 5.6 | % | 18955520 |
NPT993 | Cell Line | Hepatocyte | Mus musculus | Inhibition | = | 2.2 | % | 18955520 |
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 NPC89374 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 |
---|---|---|
0.9296 | High Similarity | NPC7382 |
0.9054 | High Similarity | NPC476627 |
0.8684 | High Similarity | NPC472013 |
0.8684 | High Similarity | NPC476624 |
0.8533 | High Similarity | NPC182848 |
0.85 | High Similarity | NPC476628 |
0.8354 | Intermediate Similarity | NPC133844 |
0.8333 | Intermediate Similarity | NPC233352 |
0.8333 | Intermediate Similarity | NPC138492 |
0.8333 | Intermediate Similarity | NPC824 |
0.8243 | Intermediate Similarity | NPC106309 |
0.8228 | Intermediate Similarity | NPC171665 |
0.8158 | Intermediate Similarity | NPC77501 |
0.8125 | Intermediate Similarity | NPC256750 |
0.8125 | Intermediate Similarity | NPC20262 |
0.8052 | Intermediate Similarity | NPC141346 |
0.8052 | Intermediate Similarity | NPC124289 |
0.8052 | Intermediate Similarity | NPC115719 |
0.8052 | Intermediate Similarity | NPC473437 |
0.8052 | Intermediate Similarity | NPC142759 |
0.8052 | Intermediate Similarity | NPC25908 |
0.8 | Intermediate Similarity | NPC29328 |
0.7975 | Intermediate Similarity | NPC66677 |
0.7975 | Intermediate Similarity | NPC301769 |
0.7975 | Intermediate Similarity | NPC32758 |
0.7975 | Intermediate Similarity | NPC84185 |
0.7975 | Intermediate Similarity | NPC471890 |
0.7949 | Intermediate Similarity | NPC472014 |
0.7895 | Intermediate Similarity | NPC300940 |
0.7875 | Intermediate Similarity | NPC74445 |
0.7875 | Intermediate Similarity | NPC287817 |
0.7791 | Intermediate Similarity | NPC77337 |
0.7763 | Intermediate Similarity | NPC469737 |
0.7738 | Intermediate Similarity | NPC476043 |
0.7733 | Intermediate Similarity | NPC67608 |
0.7703 | Intermediate Similarity | NPC278895 |
0.7703 | Intermediate Similarity | NPC476626 |
0.7674 | Intermediate Similarity | NPC170775 |
0.7671 | Intermediate Similarity | NPC474329 |
0.7671 | Intermediate Similarity | NPC474304 |
0.7654 | Intermediate Similarity | NPC164218 |
0.7654 | Intermediate Similarity | NPC30675 |
0.7632 | Intermediate Similarity | NPC280256 |
0.7558 | Intermediate Similarity | NPC472677 |
0.7558 | Intermediate Similarity | NPC58532 |
0.7532 | Intermediate Similarity | NPC288667 |
0.75 | Intermediate Similarity | NPC90446 |
0.7468 | Intermediate Similarity | NPC474011 |
0.7439 | Intermediate Similarity | NPC45495 |
0.7436 | Intermediate Similarity | NPC275098 |
0.7412 | Intermediate Similarity | NPC179006 |
0.7412 | Intermediate Similarity | NPC474853 |
0.7397 | Intermediate Similarity | NPC190049 |
0.7375 | Intermediate Similarity | NPC472305 |
0.7375 | Intermediate Similarity | NPC215481 |
0.7342 | Intermediate Similarity | NPC206875 |
0.7317 | Intermediate Similarity | NPC7232 |
0.7303 | Intermediate Similarity | NPC144629 |
0.7284 | Intermediate Similarity | NPC34110 |
0.7284 | Intermediate Similarity | NPC86917 |
0.7273 | Intermediate Similarity | NPC469914 |
0.7273 | Intermediate Similarity | NPC205548 |
0.7253 | Intermediate Similarity | NPC261341 |
0.725 | Intermediate Similarity | NPC251435 |
0.7241 | Intermediate Similarity | NPC237540 |
0.7229 | Intermediate Similarity | NPC472948 |
0.7215 | Intermediate Similarity | NPC247586 |
0.7204 | Intermediate Similarity | NPC244411 |
0.72 | Intermediate Similarity | NPC61473 |
0.7191 | Intermediate Similarity | NPC71533 |
0.7191 | Intermediate Similarity | NPC106510 |
0.7188 | Intermediate Similarity | NPC100487 |
0.7179 | Intermediate Similarity | NPC18543 |
0.7176 | Intermediate Similarity | NPC65350 |
0.716 | Intermediate Similarity | NPC469646 |
0.716 | Intermediate Similarity | NPC151622 |
0.716 | Intermediate Similarity | NPC7629 |
0.7159 | Intermediate Similarity | NPC474854 |
0.7143 | Intermediate Similarity | NPC476614 |
0.7126 | Intermediate Similarity | NPC194417 |
0.7126 | Intermediate Similarity | NPC67493 |
0.7111 | Intermediate Similarity | NPC476705 |
0.7105 | Intermediate Similarity | NPC197089 |
0.7101 | Intermediate Similarity | NPC474141 |
0.7097 | Intermediate Similarity | NPC477949 |
0.7093 | Intermediate Similarity | NPC472957 |
0.7093 | Intermediate Similarity | NPC472958 |
0.7089 | Intermediate Similarity | NPC84790 |
0.7079 | Intermediate Similarity | NPC268298 |
0.7079 | Intermediate Similarity | NPC232747 |
0.7073 | Intermediate Similarity | NPC471061 |
0.7073 | Intermediate Similarity | NPC266193 |
0.7073 | Intermediate Similarity | NPC257666 |
0.7065 | Intermediate Similarity | NPC469873 |
0.7053 | Intermediate Similarity | NPC62670 |
0.7053 | Intermediate Similarity | NPC116139 |
0.7042 | Intermediate Similarity | NPC20603 |
0.7037 | Intermediate Similarity | NPC201263 |
0.7033 | Intermediate Similarity | NPC135776 |
0.7024 | Intermediate Similarity | NPC470947 |
0.7024 | Intermediate Similarity | NPC470946 |
0.7024 | Intermediate Similarity | NPC476625 |
0.7024 | Intermediate Similarity | NPC470945 |
0.7021 | Intermediate Similarity | NPC470541 |
0.7011 | Intermediate Similarity | NPC261380 |
0.7011 | Intermediate Similarity | NPC146850 |
0.7011 | Intermediate Similarity | NPC287015 |
0.7011 | Intermediate Similarity | NPC245434 |
0.7011 | Intermediate Similarity | NPC125290 |
0.7011 | Intermediate Similarity | NPC15807 |
0.7 | Intermediate Similarity | NPC301969 |
0.7 | Intermediate Similarity | NPC37607 |
0.7 | Intermediate Similarity | NPC129419 |
0.6989 | Remote Similarity | NPC9812 |
0.6988 | Remote Similarity | NPC299235 |
0.6988 | Remote Similarity | NPC19443 |
0.6988 | Remote Similarity | NPC275494 |
0.6988 | Remote Similarity | NPC207772 |
0.6988 | Remote Similarity | NPC297996 |
0.6988 | Remote Similarity | NPC471409 |
0.6988 | Remote Similarity | NPC169095 |
0.6988 | Remote Similarity | NPC478122 |
0.6988 | Remote Similarity | NPC192006 |
0.6979 | Remote Similarity | NPC66110 |
0.6974 | Remote Similarity | NPC261782 |
0.6974 | Remote Similarity | NPC205618 |
0.6974 | Remote Similarity | NPC469326 |
0.6957 | Remote Similarity | NPC298919 |
0.6957 | Remote Similarity | NPC167219 |
0.6951 | Remote Similarity | NPC271070 |
0.6951 | Remote Similarity | NPC263582 |
0.6947 | Remote Similarity | NPC280963 |
0.6941 | Remote Similarity | NPC275766 |
0.6941 | Remote Similarity | NPC47031 |
0.6941 | Remote Similarity | NPC470241 |
0.6941 | Remote Similarity | NPC78677 |
0.6941 | Remote Similarity | NPC59994 |
0.6932 | Remote Similarity | NPC472869 |
0.6923 | Remote Similarity | NPC261607 |
0.6923 | Remote Similarity | NPC111114 |
0.6923 | Remote Similarity | NPC300312 |
0.6905 | Remote Similarity | NPC229204 |
0.6905 | Remote Similarity | NPC258231 |
0.6905 | Remote Similarity | NPC261125 |
0.6905 | Remote Similarity | NPC181195 |
0.6905 | Remote Similarity | NPC281138 |
0.6905 | Remote Similarity | NPC308038 |
0.6897 | Remote Similarity | NPC165287 |
0.6897 | Remote Similarity | NPC156485 |
0.6892 | Remote Similarity | NPC40206 |
0.6889 | Remote Similarity | NPC32922 |
0.6883 | Remote Similarity | NPC142423 |
0.6883 | Remote Similarity | NPC100719 |
0.6883 | Remote Similarity | NPC230107 |
0.6883 | Remote Similarity | NPC308294 |
0.6883 | Remote Similarity | NPC166791 |
0.6883 | Remote Similarity | NPC322035 |
0.6882 | Remote Similarity | NPC170120 |
0.6875 | Remote Similarity | NPC144627 |
0.6875 | Remote Similarity | NPC206079 |
0.6867 | Remote Similarity | NPC15975 |
0.6867 | Remote Similarity | NPC97377 |
0.6867 | Remote Similarity | NPC195785 |
0.6867 | Remote Similarity | NPC103987 |
0.6867 | Remote Similarity | NPC53581 |
0.686 | Remote Similarity | NPC85772 |
0.686 | Remote Similarity | NPC129080 |
0.686 | Remote Similarity | NPC92226 |
0.686 | Remote Similarity | NPC477269 |
0.686 | Remote Similarity | NPC193347 |
0.686 | Remote Similarity | NPC477270 |
0.686 | Remote Similarity | NPC477271 |
0.686 | Remote Similarity | NPC469325 |
0.686 | Remote Similarity | NPC7414 |
0.6857 | Remote Similarity | NPC192962 |
0.6848 | Remote Similarity | NPC37816 |
0.6842 | Remote Similarity | NPC64742 |
0.6842 | Remote Similarity | NPC150162 |
0.6835 | Remote Similarity | NPC477448 |
0.6835 | Remote Similarity | NPC477449 |
0.6829 | Remote Similarity | NPC469678 |
0.6829 | Remote Similarity | NPC475771 |
0.6829 | Remote Similarity | NPC216791 |
0.6829 | Remote Similarity | NPC469669 |
0.6824 | Remote Similarity | NPC306095 |
0.6824 | Remote Similarity | NPC302426 |
0.6824 | Remote Similarity | NPC148685 |
0.6824 | Remote Similarity | NPC104120 |
0.6824 | Remote Similarity | NPC157895 |
0.6824 | Remote Similarity | NPC472301 |
0.6818 | Remote Similarity | NPC165162 |
0.6813 | Remote Similarity | NPC145666 |
0.6813 | Remote Similarity | NPC472866 |
0.6809 | Remote Similarity | NPC93271 |
0.6809 | Remote Similarity | NPC135576 |
0.6806 | Remote Similarity | NPC40148 |
0.68 | Remote Similarity | NPC63111 |
0.68 | Remote Similarity | NPC64985 |
0.6795 | Remote Similarity | NPC136813 |
0.6786 | Remote Similarity | NPC62336 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC89374 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 |
---|---|---|---|
0.72 | Intermediate Similarity | NPD7341 | Phase 2 |
0.7105 | Intermediate Similarity | NPD7331 | Phase 2 |
0.7059 | Intermediate Similarity | NPD4800 | Clinical (unspecified phase) |
0.7011 | Intermediate Similarity | NPD5363 | Approved |
0.6932 | Remote Similarity | NPD4519 | Discontinued |
0.6932 | Remote Similarity | NPD4623 | Approved |
0.686 | Remote Similarity | NPD4223 | Phase 3 |
0.686 | Remote Similarity | NPD4270 | Approved |
0.686 | Remote Similarity | NPD4269 | Approved |
0.686 | Remote Similarity | NPD4221 | Approved |
0.6742 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.6705 | Remote Similarity | NPD4197 | Approved |
0.6667 | Remote Similarity | NPD6371 | Approved |
0.663 | Remote Similarity | NPD5785 | Approved |
0.6629 | Remote Similarity | NPD5329 | Approved |
0.6628 | Remote Similarity | NPD4252 | Approved |
0.6596 | Remote Similarity | NPD5282 | Discontinued |
0.6591 | Remote Similarity | NPD5362 | Discontinued |
0.6556 | Remote Similarity | NPD4688 | Approved |
0.6556 | Remote Similarity | NPD4138 | Approved |
0.6556 | Remote Similarity | NPD4693 | Phase 3 |
0.6556 | Remote Similarity | NPD5280 | Approved |
0.6556 | Remote Similarity | NPD5690 | Phase 2 |
0.6556 | Remote Similarity | NPD4690 | Approved |
0.6556 | Remote Similarity | NPD5205 | Approved |
0.6556 | Remote Similarity | NPD5786 | Approved |
0.6556 | Remote Similarity | NPD4694 | Approved |
0.6556 | Remote Similarity | NPD4689 | Approved |
0.6552 | Remote Similarity | NPD5369 | Approved |
0.6535 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6517 | Remote Similarity | NPD3666 | Approved |
0.6517 | Remote Similarity | NPD3133 | Approved |
0.6517 | Remote Similarity | NPD3665 | Phase 1 |
0.6413 | Remote Similarity | NPD4518 | Approved |
0.6404 | Remote Similarity | NPD7154 | Phase 3 |
0.6395 | Remote Similarity | NPD3617 | Approved |
0.6395 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6354 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.6344 | Remote Similarity | NPD4753 | Phase 2 |
0.6277 | Remote Similarity | NPD4096 | Approved |
0.625 | Remote Similarity | NPD4822 | Approved |
0.625 | Remote Similarity | NPD4820 | Approved |
0.625 | Remote Similarity | NPD4821 | Approved |
0.625 | Remote Similarity | NPD4695 | Discontinued |
0.625 | Remote Similarity | NPD4819 | Approved |
0.6211 | Remote Similarity | NPD5281 | Approved |
0.6211 | Remote Similarity | NPD5284 | Approved |
0.6196 | Remote Similarity | NPD3618 | Phase 1 |
0.6196 | Remote Similarity | NPD5279 | Phase 3 |
0.618 | Remote Similarity | NPD4139 | Approved |
0.618 | Remote Similarity | NPD4692 | Approved |
0.617 | Remote Similarity | NPD1695 | Approved |
0.6146 | Remote Similarity | NPD4202 | Approved |
0.6146 | Remote Similarity | NPD5779 | Approved |
0.6146 | Remote Similarity | NPD5778 | Approved |
0.6136 | Remote Similarity | NPD4195 | Approved |
0.6111 | Remote Similarity | NPD3667 | Approved |
0.6087 | Remote Similarity | NPD1696 | Phase 3 |
0.6076 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.6067 | Remote Similarity | NPD5368 | Approved |
0.6044 | Remote Similarity | NPD5332 | Approved |
0.6044 | Remote Similarity | NPD4788 | Approved |
0.6044 | Remote Similarity | NPD5331 | Approved |
0.6042 | Remote Similarity | NPD7983 | Approved |
0.6023 | Remote Similarity | NPD4268 | Approved |
0.6023 | Remote Similarity | NPD4271 | Approved |
0.602 | Remote Similarity | NPD4629 | Approved |
0.602 | Remote Similarity | NPD5695 | Phase 3 |
0.602 | Remote Similarity | NPD5210 | Approved |
0.6 | Remote Similarity | NPD5328 | Approved |
0.6 | Remote Similarity | NPD4790 | Discontinued |
0.598 | Remote Similarity | NPD5211 | Phase 2 |
0.5979 | Remote Similarity | NPD5133 | Approved |
0.5978 | Remote Similarity | NPD4786 | Approved |
0.5938 | Remote Similarity | NPD46 | Approved |
0.5938 | Remote Similarity | NPD6698 | Approved |
0.5934 | Remote Similarity | NPD6435 | Approved |
0.5934 | Remote Similarity | NPD5209 | Approved |
0.5909 | Remote Similarity | NPD4756 | Discovery |
0.59 | Remote Similarity | NPD6084 | Phase 2 |
0.59 | Remote Similarity | NPD4755 | Approved |
0.59 | Remote Similarity | NPD6083 | Phase 2 |
0.5895 | Remote Similarity | NPD5208 | Approved |
0.5889 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5888 | Remote Similarity | NPD4634 | Approved |
0.5876 | Remote Similarity | NPD6079 | Approved |
0.5876 | Remote Similarity | NPD5693 | Phase 1 |
0.5865 | Remote Similarity | NPD5141 | Approved |
0.5851 | Remote Similarity | NPD5330 | Approved |
0.5851 | Remote Similarity | NPD7146 | Approved |
0.5851 | Remote Similarity | NPD7521 | Approved |
0.5851 | Remote Similarity | NPD6409 | Approved |
0.5851 | Remote Similarity | NPD6684 | Approved |
0.5851 | Remote Similarity | NPD4249 | Approved |
0.5851 | Remote Similarity | NPD7334 | Approved |
0.5842 | Remote Similarity | NPD5696 | Approved |
0.5833 | Remote Similarity | NPD4137 | Phase 3 |
0.5833 | Remote Similarity | NPD6080 | Approved |
0.5833 | Remote Similarity | NPD6673 | Approved |
0.5833 | Remote Similarity | NPD6904 | Approved |
0.5833 | Remote Similarity | NPD5370 | Suspended |
0.5824 | Remote Similarity | NPD857 | Phase 3 |
0.58 | Remote Similarity | NPD7839 | Suspended |
0.5789 | Remote Similarity | NPD342 | Phase 1 |
0.5789 | Remote Similarity | NPD4251 | Approved |
0.5789 | Remote Similarity | NPD4250 | Approved |
0.5784 | Remote Similarity | NPD5285 | Approved |
0.5784 | Remote Similarity | NPD7639 | Approved |
0.5784 | Remote Similarity | NPD4700 | Approved |
0.5784 | Remote Similarity | NPD7640 | Approved |
0.5784 | Remote Similarity | NPD5286 | Approved |
0.5784 | Remote Similarity | NPD4696 | Approved |
0.578 | Remote Similarity | NPD6053 | Discontinued |
0.5773 | Remote Similarity | NPD5207 | Approved |
0.5773 | Remote Similarity | NPD5692 | Phase 3 |
0.5765 | Remote Similarity | NPD4691 | Approved |
0.5765 | Remote Similarity | NPD4747 | Approved |
0.5761 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.575 | Remote Similarity | NPD368 | Approved |
0.5745 | Remote Similarity | NPD1694 | Approved |
0.5745 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.5733 | Remote Similarity | NPD3172 | Approved |
0.5729 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.5729 | Remote Similarity | NPD6903 | Approved |
0.5728 | Remote Similarity | NPD5223 | Approved |
0.5714 | Remote Similarity | NPD6930 | Phase 2 |
0.5714 | Remote Similarity | NPD6050 | Approved |
0.5714 | Remote Similarity | NPD5694 | Approved |
0.5714 | Remote Similarity | NPD7637 | Suspended |
0.5714 | Remote Similarity | NPD4810 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD7332 | Phase 2 |
0.5714 | Remote Similarity | NPD6931 | Approved |
0.5699 | Remote Similarity | NPD6110 | Phase 1 |
0.5698 | Remote Similarity | NPD5276 | Approved |
0.5686 | Remote Similarity | NPD7638 | Approved |
0.5684 | Remote Similarity | NPD6098 | Approved |
0.5673 | Remote Similarity | NPD5091 | Approved |
0.5673 | Remote Similarity | NPD5224 | Approved |
0.5673 | Remote Similarity | NPD5225 | Approved |
0.5673 | Remote Similarity | NPD4633 | Approved |
0.5673 | Remote Similarity | NPD5226 | Approved |
0.5663 | Remote Similarity | NPD3704 | Approved |
0.5658 | Remote Similarity | NPD3195 | Phase 2 |
0.5658 | Remote Similarity | NPD3196 | Approved |
0.5658 | Remote Similarity | NPD4266 | Approved |
0.5658 | Remote Similarity | NPD3194 | Approved |
0.5644 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.5644 | Remote Similarity | NPD4697 | Phase 3 |
0.5644 | Remote Similarity | NPD5221 | Approved |
0.5644 | Remote Similarity | NPD5222 | Approved |
0.5638 | Remote Similarity | NPD3668 | Phase 3 |
0.5631 | Remote Similarity | NPD6404 | Discontinued |
0.5625 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.5619 | Remote Similarity | NPD5175 | Approved |
0.5619 | Remote Similarity | NPD4754 | Approved |
0.5619 | Remote Similarity | NPD5174 | Approved |
0.5607 | Remote Similarity | NPD6412 | Phase 2 |
0.5604 | Remote Similarity | NPD6929 | Approved |
0.56 | Remote Similarity | NPD6001 | Approved |
PubChem CID   | 10083471 |
ChEMBL   | CHEMBL504340 |
ZINC   |
Molecular Weight:   | 250.16 |
ALogP:   | 0.9164 |
MLogP:   | 2.78 |
XLogP:   | 0.465 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 57.53 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 2 |
# Rings:   | 2 |
# Heavy Atoms:   | 18 |