Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | > | 100000 | nM | 10.1007/s00044-011-9827-6 | |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | > | 100000 | nM | 12954063 |
NPT1210 | Individual Protein | T-cell protein-tyrosine phosphatase | Homo sapiens | IC50 | = | 12560 | nM | 10.6019/CHEMBL1201861 |
NPT1870 | Individual Protein | Receptor-type tyrosine-protein phosphatase F (LAR) | Homo sapiens | Inhibition | < | 50 | % | 19902967 |
NPT205 | Individual Protein | Protein-tyrosine phosphatase 1C | Homo sapiens | Inhibition | < | 50 | % | 10479316 |
NPT911 | Individual Protein | Dual specificity phosphatase Cdc25B | Homo sapiens | IC50 | = | 42920 | nM | PubChem BioAssay data set |
NPT206 | Individual Protein | Protein-tyrosine phosphatase 2C | Homo sapiens | Inhibition | < | 50 | % | 20547801 |
NPT178 | Individual Protein | Protein-tyrosine phosphatase 1B | Homo sapiens | IC50 | = | 2300 | nM | 17850214 |
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 NPC472264 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 |
---|---|---|
0.7333 | Intermediate Similarity | NPC271269 |
0.7333 | Intermediate Similarity | NPC154601 |
0.7264 | Intermediate Similarity | NPC251330 |
0.699 | Remote Similarity | NPC167380 |
0.699 | Remote Similarity | NPC4834 |
0.6893 | Remote Similarity | NPC121857 |
0.6887 | Remote Similarity | NPC469598 |
0.6796 | Remote Similarity | NPC150041 |
0.6771 | Remote Similarity | NPC471296 |
0.6739 | Remote Similarity | NPC329852 |
0.6667 | Remote Similarity | NPC474828 |
0.6667 | Remote Similarity | NPC474827 |
0.6667 | Remote Similarity | NPC476344 |
0.6667 | Remote Similarity | NPC199831 |
0.6667 | Remote Similarity | NPC68001 |
0.6667 | Remote Similarity | NPC52820 |
0.6667 | Remote Similarity | NPC265662 |
0.6667 | Remote Similarity | NPC67183 |
0.6636 | Remote Similarity | NPC175531 |
0.6633 | Remote Similarity | NPC31086 |
0.6633 | Remote Similarity | NPC474865 |
0.663 | Remote Similarity | NPC474758 |
0.6628 | Remote Similarity | NPC68110 |
0.6607 | Remote Similarity | NPC122926 |
0.6607 | Remote Similarity | NPC113012 |
0.6607 | Remote Similarity | NPC469603 |
0.6606 | Remote Similarity | NPC472616 |
0.6606 | Remote Similarity | NPC469604 |
0.6602 | Remote Similarity | NPC304897 |
0.6593 | Remote Similarity | NPC257618 |
0.6569 | Remote Similarity | NPC47230 |
0.6569 | Remote Similarity | NPC17143 |
0.6566 | Remote Similarity | NPC474860 |
0.6566 | Remote Similarity | NPC471300 |
0.6552 | Remote Similarity | NPC34883 |
0.6526 | Remote Similarity | NPC108816 |
0.6526 | Remote Similarity | NPC474816 |
0.6526 | Remote Similarity | NPC93763 |
0.6526 | Remote Similarity | NPC209135 |
0.6518 | Remote Similarity | NPC24389 |
0.6517 | Remote Similarity | NPC472266 |
0.6509 | Remote Similarity | NPC150967 |
0.65 | Remote Similarity | NPC469483 |
0.6495 | Remote Similarity | NPC325031 |
0.6484 | Remote Similarity | NPC4299 |
0.6471 | Remote Similarity | NPC295312 |
0.6452 | Remote Similarity | NPC15499 |
0.6452 | Remote Similarity | NPC117746 |
0.6452 | Remote Similarity | NPC294434 |
0.6452 | Remote Similarity | NPC259599 |
0.6444 | Remote Similarity | NPC249713 |
0.6429 | Remote Similarity | NPC474099 |
0.6429 | Remote Similarity | NPC173609 |
0.6422 | Remote Similarity | NPC474244 |
0.6421 | Remote Similarity | NPC473756 |
0.6421 | Remote Similarity | NPC262747 |
0.6415 | Remote Similarity | NPC175614 |
0.6408 | Remote Similarity | NPC473448 |
0.64 | Remote Similarity | NPC30984 |
0.64 | Remote Similarity | NPC65661 |
0.6396 | Remote Similarity | NPC472615 |
0.6389 | Remote Similarity | NPC26597 |
0.6383 | Remote Similarity | NPC68624 |
0.6374 | Remote Similarity | NPC280065 |
0.6374 | Remote Similarity | NPC101622 |
0.6374 | Remote Similarity | NPC45060 |
0.6364 | Remote Similarity | NPC16488 |
0.6354 | Remote Similarity | NPC471220 |
0.6354 | Remote Similarity | NPC128276 |
0.6337 | Remote Similarity | NPC305475 |
0.6337 | Remote Similarity | NPC316426 |
0.6337 | Remote Similarity | NPC122502 |
0.6337 | Remote Similarity | NPC315395 |
0.6337 | Remote Similarity | NPC475461 |
0.6337 | Remote Similarity | NPC261721 |
0.633 | Remote Similarity | NPC474873 |
0.633 | Remote Similarity | NPC188785 |
0.6327 | Remote Similarity | NPC112868 |
0.6327 | Remote Similarity | NPC471325 |
0.6327 | Remote Similarity | NPC475944 |
0.6316 | Remote Similarity | NPC328052 |
0.6316 | Remote Similarity | NPC469880 |
0.6316 | Remote Similarity | NPC27205 |
0.6316 | Remote Similarity | NPC127578 |
0.6311 | Remote Similarity | NPC174342 |
0.63 | Remote Similarity | NPC82297 |
0.63 | Remote Similarity | NPC243618 |
0.63 | Remote Similarity | NPC149869 |
0.63 | Remote Similarity | NPC70424 |
0.6289 | Remote Similarity | NPC471299 |
0.6277 | Remote Similarity | NPC470686 |
0.6275 | Remote Similarity | NPC312561 |
0.6275 | Remote Similarity | NPC472614 |
0.6275 | Remote Similarity | NPC160138 |
0.6273 | Remote Similarity | NPC128501 |
0.6271 | Remote Similarity | NPC476190 |
0.6264 | Remote Similarity | NPC276290 |
0.6263 | Remote Similarity | NPC35556 |
0.6263 | Remote Similarity | NPC85772 |
0.6263 | Remote Similarity | NPC323251 |
0.6263 | Remote Similarity | NPC324170 |
0.6263 | Remote Similarity | NPC471298 |
0.6262 | Remote Similarity | NPC247220 |
0.625 | Remote Similarity | NPC476004 |
0.625 | Remote Similarity | NPC320630 |
0.625 | Remote Similarity | NPC474761 |
0.625 | Remote Similarity | NPC232426 |
0.625 | Remote Similarity | NPC281942 |
0.625 | Remote Similarity | NPC7563 |
0.625 | Remote Similarity | NPC57744 |
0.625 | Remote Similarity | NPC477782 |
0.625 | Remote Similarity | NPC315394 |
0.625 | Remote Similarity | NPC116177 |
0.625 | Remote Similarity | NPC155849 |
0.6239 | Remote Similarity | NPC476813 |
0.6239 | Remote Similarity | NPC103391 |
0.6239 | Remote Similarity | NPC476814 |
0.6239 | Remote Similarity | NPC472536 |
0.6238 | Remote Similarity | NPC474424 |
0.6238 | Remote Similarity | NPC261380 |
0.6238 | Remote Similarity | NPC106416 |
0.6238 | Remote Similarity | NPC86316 |
0.6238 | Remote Similarity | NPC137033 |
0.6238 | Remote Similarity | NPC255307 |
0.6237 | Remote Similarity | NPC472254 |
0.6226 | Remote Similarity | NPC469632 |
0.6216 | Remote Similarity | NPC474563 |
0.6214 | Remote Similarity | NPC227379 |
0.6214 | Remote Similarity | NPC474471 |
0.62 | Remote Similarity | NPC42476 |
0.62 | Remote Similarity | NPC40746 |
0.62 | Remote Similarity | NPC169575 |
0.62 | Remote Similarity | NPC471297 |
0.62 | Remote Similarity | NPC475947 |
0.62 | Remote Similarity | NPC474809 |
0.6196 | Remote Similarity | NPC265574 |
0.6196 | Remote Similarity | NPC151481 |
0.619 | Remote Similarity | NPC141831 |
0.619 | Remote Similarity | NPC477783 |
0.619 | Remote Similarity | NPC314500 |
0.6186 | Remote Similarity | NPC127526 |
0.6186 | Remote Similarity | NPC267231 |
0.6186 | Remote Similarity | NPC192006 |
0.6182 | Remote Similarity | NPC77703 |
0.6176 | Remote Similarity | NPC284902 |
0.6176 | Remote Similarity | NPC211892 |
0.6176 | Remote Similarity | NPC164393 |
0.6176 | Remote Similarity | NPC234038 |
0.6174 | Remote Similarity | NPC476290 |
0.617 | Remote Similarity | NPC477085 |
0.617 | Remote Similarity | NPC222244 |
0.617 | Remote Similarity | NPC16349 |
0.617 | Remote Similarity | NPC144419 |
0.6162 | Remote Similarity | NPC40228 |
0.6162 | Remote Similarity | NPC229584 |
0.6162 | Remote Similarity | NPC14203 |
0.6161 | Remote Similarity | NPC14537 |
0.6154 | Remote Similarity | NPC5509 |
0.6154 | Remote Similarity | NPC194871 |
0.6154 | Remote Similarity | NPC5485 |
0.6154 | Remote Similarity | NPC474032 |
0.6154 | Remote Similarity | NPC212598 |
0.6154 | Remote Similarity | NPC268298 |
0.6147 | Remote Similarity | NPC234542 |
0.6146 | Remote Similarity | NPC68819 |
0.6146 | Remote Similarity | NPC61863 |
0.6146 | Remote Similarity | NPC123360 |
0.614 | Remote Similarity | NPC140251 |
0.614 | Remote Similarity | NPC307903 |
0.6139 | Remote Similarity | NPC96259 |
0.6139 | Remote Similarity | NPC472957 |
0.6139 | Remote Similarity | NPC474776 |
0.6139 | Remote Similarity | NPC14575 |
0.6139 | Remote Similarity | NPC114979 |
0.6139 | Remote Similarity | NPC472958 |
0.6139 | Remote Similarity | NPC196487 |
0.6139 | Remote Similarity | NPC191476 |
0.6139 | Remote Similarity | NPC471301 |
0.6139 | Remote Similarity | NPC471302 |
0.6139 | Remote Similarity | NPC9868 |
0.6139 | Remote Similarity | NPC126518 |
0.6139 | Remote Similarity | NPC476804 |
0.6139 | Remote Similarity | NPC141193 |
0.6129 | Remote Similarity | NPC64234 |
0.6129 | Remote Similarity | NPC473361 |
0.6129 | Remote Similarity | NPC37929 |
0.6129 | Remote Similarity | NPC469660 |
0.6129 | Remote Similarity | NPC329904 |
0.6122 | Remote Similarity | NPC471597 |
0.6122 | Remote Similarity | NPC178277 |
0.6122 | Remote Similarity | NPC469620 |
0.6122 | Remote Similarity | NPC89128 |
0.6122 | Remote Similarity | NPC469617 |
0.6122 | Remote Similarity | NPC469690 |
0.6118 | Remote Similarity | NPC96663 |
0.6117 | Remote Similarity | NPC45409 |
0.6111 | Remote Similarity | NPC470688 |
0.6111 | Remote Similarity | NPC282760 |
0.6111 | Remote Similarity | NPC123141 |
0.6106 | Remote Similarity | NPC101106 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC472264 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 |
---|---|---|---|
0.6286 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.6271 | Remote Similarity | NPD7505 | Discontinued |
0.6261 | Remote Similarity | NPD7116 | Clinical (unspecified phase) |
0.6174 | Remote Similarity | NPD6420 | Discontinued |
0.6139 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6106 | Remote Similarity | NPD4211 | Phase 1 |
0.61 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD6413 | Approved |
0.604 | Remote Similarity | NPD7154 | Phase 3 |
0.6 | Remote Similarity | NPD7500 | Approved |
0.5946 | Remote Similarity | NPD6404 | Discontinued |
0.5943 | Remote Similarity | NPD46 | Approved |
0.5943 | Remote Similarity | NPD6698 | Approved |
0.5943 | Remote Similarity | NPD5785 | Approved |
0.5935 | Remote Similarity | NPD7739 | Clinical (unspecified phase) |
0.5934 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.5922 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.59 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5887 | Remote Similarity | NPD7623 | Phase 3 |
0.5887 | Remote Similarity | NPD7624 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD5362 | Discontinued |
0.5859 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5847 | Remote Similarity | NPD2204 | Approved |
0.5818 | Remote Similarity | NPD4228 | Discovery |
0.5818 | Remote Similarity | NPD7839 | Suspended |
0.5814 | Remote Similarity | NPD6914 | Discontinued |
0.5804 | Remote Similarity | NPD7640 | Approved |
0.5804 | Remote Similarity | NPD7639 | Approved |
0.5789 | Remote Similarity | NPD2258 | Approved |
0.5789 | Remote Similarity | NPD2259 | Approved |
0.5784 | Remote Similarity | NPD5209 | Approved |
0.5769 | Remote Similarity | NPD5363 | Approved |
0.575 | Remote Similarity | NPD1376 | Discontinued |
0.5743 | Remote Similarity | NPD4822 | Approved |
0.5743 | Remote Similarity | NPD4821 | Approved |
0.5743 | Remote Similarity | NPD4820 | Approved |
0.5743 | Remote Similarity | NPD4819 | Approved |
0.5728 | Remote Similarity | NPD5332 | Approved |
0.5728 | Remote Similarity | NPD5331 | Approved |
0.5714 | Remote Similarity | NPD7638 | Approved |
0.5714 | Remote Similarity | NPD8039 | Approved |
0.5714 | Remote Similarity | NPD7601 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD1719 | Phase 1 |
0.5714 | Remote Similarity | NPD5786 | Approved |
0.57 | Remote Similarity | NPD4271 | Approved |
0.57 | Remote Similarity | NPD4268 | Approved |
0.5686 | Remote Similarity | NPD4790 | Discontinued |
0.5648 | Remote Similarity | NPD6095 | Approved |
0.5648 | Remote Similarity | NPD6094 | Approved |
0.5648 | Remote Similarity | NPD7838 | Discovery |
0.5631 | Remote Similarity | NPD4269 | Approved |
0.5631 | Remote Similarity | NPD6435 | Approved |
0.5631 | Remote Similarity | NPD4270 | Approved |
0.563 | Remote Similarity | NPD6421 | Discontinued |
0.56 | Remote Similarity | NPD7299 | Clinical (unspecified phase) |
PubChem CID   | |
ChEMBL   | CHEMBL3356396 |
ZINC   |
Molecular Weight:   | 461.35 |
ALogP:   | 2.1153 |
MLogP:   | 3.99 |
XLogP:   | 9.48 |
# Rotatable Bonds:   | 25 |
Polar Surface Area:   | 75.96 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 1 |
# Rings:   | 1 |
# Heavy Atoms:   | 33 |