Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Activity | = | 43 | % | 1517739 | |
NPT2 | Others | Unspecified | IC50 | = | 10200 | nM | 22749279 | |
NPT71 | Cell Line | HEK293 | Homo sapiens | Survival | = | 55 | % | 24195447 |
NPT6622 | Individual Protein | Signal transducer and activator of transcription 3 | Mus musculus | Activity | = | 28 | % | 19271765 |
NPT113 | Cell Line | RAW264.7 | Mus musculus | Survival | = | 18 | % | 10.6019/CHEMBL1201861 |
NPT113 | Cell Line | RAW264.7 | Mus musculus | Inhibition | = | 99.3 | % | 12617583 |
NPT113 | Cell Line | RAW264.7 | Mus musculus | IC50 | = | 2700 | nM | 15808471 |
NPT4097 | Individual Protein | Signal transducer and activator of transcription 1 | Mus musculus | Activity | = | 60 | % | 20923180 |
NPT2 | Others | Unspecified | Inhibition | = | 90.3 | % | PubChem BioAssay data set |
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 NPC3436 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 |
---|---|---|
0.9882 | High Similarity | NPC470520 |
0.9881 | High Similarity | NPC225283 |
0.9767 | High Similarity | NPC59646 |
0.9655 | High Similarity | NPC470521 |
0.9425 | High Similarity | NPC32494 |
0.9425 | High Similarity | NPC175842 |
0.9222 | High Similarity | NPC473333 |
0.9121 | High Similarity | NPC2666 |
0.8977 | High Similarity | NPC64913 |
0.8977 | High Similarity | NPC242877 |
0.8901 | High Similarity | NPC471492 |
0.871 | High Similarity | NPC471490 |
0.8652 | High Similarity | NPC260343 |
0.8163 | Intermediate Similarity | NPC291500 |
0.8163 | Intermediate Similarity | NPC140591 |
0.8163 | Intermediate Similarity | NPC189609 |
0.8163 | Intermediate Similarity | NPC303653 |
0.8163 | Intermediate Similarity | NPC197835 |
0.8125 | Intermediate Similarity | NPC471462 |
0.8 | Intermediate Similarity | NPC474338 |
0.7912 | Intermediate Similarity | NPC471185 |
0.7864 | Intermediate Similarity | NPC38154 |
0.7857 | Intermediate Similarity | NPC187268 |
0.7816 | Intermediate Similarity | NPC315394 |
0.7778 | Intermediate Similarity | NPC469872 |
0.7778 | Intermediate Similarity | NPC469864 |
0.7717 | Intermediate Similarity | NPC130030 |
0.7708 | Intermediate Similarity | NPC471483 |
0.7674 | Intermediate Similarity | NPC470686 |
0.7667 | Intermediate Similarity | NPC112868 |
0.7653 | Intermediate Similarity | NPC301596 |
0.7653 | Intermediate Similarity | NPC299396 |
0.7634 | Intermediate Similarity | NPC475461 |
0.7634 | Intermediate Similarity | NPC305475 |
0.7629 | Intermediate Similarity | NPC469632 |
0.7609 | Intermediate Similarity | NPC475706 |
0.7604 | Intermediate Similarity | NPC2882 |
0.7604 | Intermediate Similarity | NPC158061 |
0.7573 | Intermediate Similarity | NPC81630 |
0.7527 | Intermediate Similarity | NPC255307 |
0.7527 | Intermediate Similarity | NPC470755 |
0.7526 | Intermediate Similarity | NPC472954 |
0.7526 | Intermediate Similarity | NPC189651 |
0.7526 | Intermediate Similarity | NPC475098 |
0.75 | Intermediate Similarity | NPC474809 |
0.7475 | Intermediate Similarity | NPC172998 |
0.7475 | Intermediate Similarity | NPC230800 |
0.7474 | Intermediate Similarity | NPC472378 |
0.7474 | Intermediate Similarity | NPC475819 |
0.7474 | Intermediate Similarity | NPC476805 |
0.7473 | Intermediate Similarity | NPC474894 |
0.7447 | Intermediate Similarity | NPC261721 |
0.7447 | Intermediate Similarity | NPC311163 |
0.7423 | Intermediate Similarity | NPC261607 |
0.7423 | Intermediate Similarity | NPC111114 |
0.7423 | Intermediate Similarity | NPC300312 |
0.7419 | Intermediate Similarity | NPC191476 |
0.7419 | Intermediate Similarity | NPC114979 |
0.7419 | Intermediate Similarity | NPC158756 |
0.7412 | Intermediate Similarity | NPC232812 |
0.7396 | Intermediate Similarity | NPC212598 |
0.7396 | Intermediate Similarity | NPC295312 |
0.7396 | Intermediate Similarity | NPC51358 |
0.7396 | Intermediate Similarity | NPC307092 |
0.7374 | Intermediate Similarity | NPC304886 |
0.7374 | Intermediate Similarity | NPC234339 |
0.7374 | Intermediate Similarity | NPC273197 |
0.7368 | Intermediate Similarity | NPC72513 |
0.7368 | Intermediate Similarity | NPC160138 |
0.7368 | Intermediate Similarity | NPC191283 |
0.7353 | Intermediate Similarity | NPC133907 |
0.7353 | Intermediate Similarity | NPC469851 |
0.7353 | Intermediate Similarity | NPC128733 |
0.7353 | Intermediate Similarity | NPC46998 |
0.7353 | Intermediate Similarity | NPC244456 |
0.7353 | Intermediate Similarity | NPC110443 |
0.7353 | Intermediate Similarity | NPC469657 |
0.7353 | Intermediate Similarity | NPC185141 |
0.7347 | Intermediate Similarity | NPC125674 |
0.7347 | Intermediate Similarity | NPC228451 |
0.7347 | Intermediate Similarity | NPC40821 |
0.7347 | Intermediate Similarity | NPC469692 |
0.7347 | Intermediate Similarity | NPC32862 |
0.7347 | Intermediate Similarity | NPC469645 |
0.7347 | Intermediate Similarity | NPC475838 |
0.7347 | Intermediate Similarity | NPC272293 |
0.7347 | Intermediate Similarity | NPC156553 |
0.734 | Intermediate Similarity | NPC261380 |
0.734 | Intermediate Similarity | NPC165162 |
0.734 | Intermediate Similarity | NPC11804 |
0.734 | Intermediate Similarity | NPC67081 |
0.734 | Intermediate Similarity | NPC471223 |
0.7333 | Intermediate Similarity | NPC475074 |
0.7327 | Intermediate Similarity | NPC141191 |
0.7327 | Intermediate Similarity | NPC203627 |
0.7326 | Intermediate Similarity | NPC37929 |
0.7326 | Intermediate Similarity | NPC64234 |
0.7326 | Intermediate Similarity | NPC4299 |
0.732 | Intermediate Similarity | NPC129419 |
0.732 | Intermediate Similarity | NPC475879 |
0.732 | Intermediate Similarity | NPC232426 |
0.732 | Intermediate Similarity | NPC475855 |
0.732 | Intermediate Similarity | NPC473448 |
0.732 | Intermediate Similarity | NPC281942 |
0.7312 | Intermediate Similarity | NPC40746 |
0.7312 | Intermediate Similarity | NPC475714 |
0.7312 | Intermediate Similarity | NPC473390 |
0.7312 | Intermediate Similarity | NPC169575 |
0.7312 | Intermediate Similarity | NPC44261 |
0.7312 | Intermediate Similarity | NPC131669 |
0.73 | Intermediate Similarity | NPC288350 |
0.73 | Intermediate Similarity | NPC173329 |
0.73 | Intermediate Similarity | NPC16967 |
0.7292 | Intermediate Similarity | NPC26078 |
0.7292 | Intermediate Similarity | NPC472809 |
0.7292 | Intermediate Similarity | NPC476803 |
0.7292 | Intermediate Similarity | NPC472810 |
0.7292 | Intermediate Similarity | NPC473658 |
0.7292 | Intermediate Similarity | NPC471956 |
0.7283 | Intermediate Similarity | NPC475944 |
0.7283 | Intermediate Similarity | NPC78677 |
0.7283 | Intermediate Similarity | NPC325031 |
0.7283 | Intermediate Similarity | NPC59994 |
0.7283 | Intermediate Similarity | NPC315731 |
0.7273 | Intermediate Similarity | NPC96541 |
0.7273 | Intermediate Similarity | NPC121825 |
0.7273 | Intermediate Similarity | NPC470255 |
0.7273 | Intermediate Similarity | NPC191521 |
0.7273 | Intermediate Similarity | NPC167219 |
0.7273 | Intermediate Similarity | NPC474247 |
0.7263 | Intermediate Similarity | NPC469483 |
0.7263 | Intermediate Similarity | NPC469910 |
0.7263 | Intermediate Similarity | NPC150755 |
0.7263 | Intermediate Similarity | NPC116575 |
0.7255 | Intermediate Similarity | NPC288876 |
0.7253 | Intermediate Similarity | NPC471537 |
0.7245 | Intermediate Similarity | NPC141831 |
0.7238 | Intermediate Similarity | NPC469852 |
0.7234 | Intermediate Similarity | NPC141193 |
0.7234 | Intermediate Similarity | NPC471301 |
0.7234 | Intermediate Similarity | NPC476804 |
0.7234 | Intermediate Similarity | NPC82297 |
0.7234 | Intermediate Similarity | NPC96259 |
0.7228 | Intermediate Similarity | NPC475709 |
0.7228 | Intermediate Similarity | NPC53844 |
0.7228 | Intermediate Similarity | NPC169205 |
0.7216 | Intermediate Similarity | NPC268298 |
0.7216 | Intermediate Similarity | NPC470734 |
0.7216 | Intermediate Similarity | NPC212664 |
0.7212 | Intermediate Similarity | NPC471938 |
0.7209 | Intermediate Similarity | NPC101622 |
0.7209 | Intermediate Similarity | NPC475004 |
0.7204 | Intermediate Similarity | NPC474439 |
0.7204 | Intermediate Similarity | NPC474028 |
0.7204 | Intermediate Similarity | NPC229825 |
0.7204 | Intermediate Similarity | NPC11383 |
0.7204 | Intermediate Similarity | NPC471298 |
0.7204 | Intermediate Similarity | NPC323251 |
0.7204 | Intermediate Similarity | NPC89555 |
0.7204 | Intermediate Similarity | NPC310450 |
0.7204 | Intermediate Similarity | NPC475046 |
0.7204 | Intermediate Similarity | NPC474959 |
0.72 | Intermediate Similarity | NPC220221 |
0.72 | Intermediate Similarity | NPC476487 |
0.72 | Intermediate Similarity | NPC469873 |
0.72 | Intermediate Similarity | NPC13924 |
0.72 | Intermediate Similarity | NPC476488 |
0.7191 | Intermediate Similarity | NPC329852 |
0.7188 | Intermediate Similarity | NPC45409 |
0.7188 | Intermediate Similarity | NPC313658 |
0.7188 | Intermediate Similarity | NPC316138 |
0.7172 | Intermediate Similarity | NPC475912 |
0.7172 | Intermediate Similarity | NPC472812 |
0.7172 | Intermediate Similarity | NPC205034 |
0.7172 | Intermediate Similarity | NPC162615 |
0.7172 | Intermediate Similarity | NPC475302 |
0.7172 | Intermediate Similarity | NPC152778 |
0.7172 | Intermediate Similarity | NPC29798 |
0.7172 | Intermediate Similarity | NPC476049 |
0.7172 | Intermediate Similarity | NPC282644 |
0.717 | Intermediate Similarity | NPC469853 |
0.7158 | Intermediate Similarity | NPC474424 |
0.7158 | Intermediate Similarity | NPC471494 |
0.7157 | Intermediate Similarity | NPC278673 |
0.7157 | Intermediate Similarity | NPC474440 |
0.7143 | Intermediate Similarity | NPC93763 |
0.7143 | Intermediate Similarity | NPC108816 |
0.7143 | Intermediate Similarity | NPC474232 |
0.7143 | Intermediate Similarity | NPC469368 |
0.7143 | Intermediate Similarity | NPC309190 |
0.7143 | Intermediate Similarity | NPC121099 |
0.7143 | Intermediate Similarity | NPC100487 |
0.7143 | Intermediate Similarity | NPC315765 |
0.7143 | Intermediate Similarity | NPC474816 |
0.7143 | Intermediate Similarity | NPC179394 |
0.7143 | Intermediate Similarity | NPC144133 |
0.7143 | Intermediate Similarity | NPC471937 |
0.7143 | Intermediate Similarity | NPC209135 |
0.7143 | Intermediate Similarity | NPC326753 |
0.7143 | Intermediate Similarity | NPC469403 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC3436 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 |
---|---|---|---|
0.7143 | Intermediate Similarity | NPD7838 | Discovery |
0.7053 | Intermediate Similarity | NPD6400 | Clinical (unspecified phase) |
0.703 | Intermediate Similarity | NPD1698 | Clinical (unspecified phase) |
0.699 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.699 | Remote Similarity | NPD4225 | Approved |
0.6947 | Remote Similarity | NPD7154 | Phase 3 |
0.6907 | Remote Similarity | NPD4249 | Approved |
0.6837 | Remote Similarity | NPD4251 | Approved |
0.6837 | Remote Similarity | NPD4250 | Approved |
0.6733 | Remote Similarity | NPD7983 | Approved |
0.6697 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD5778 | Approved |
0.6667 | Remote Similarity | NPD5779 | Approved |
0.6635 | Remote Similarity | NPD7839 | Suspended |
0.6634 | Remote Similarity | NPD5785 | Approved |
0.6634 | Remote Similarity | NPD46 | Approved |
0.6634 | Remote Similarity | NPD6698 | Approved |
0.6633 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.6632 | Remote Similarity | NPD4822 | Approved |
0.6632 | Remote Similarity | NPD4819 | Approved |
0.6632 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.6632 | Remote Similarity | NPD4821 | Approved |
0.6632 | Remote Similarity | NPD4820 | Approved |
0.6602 | Remote Similarity | NPD5282 | Discontinued |
0.6569 | Remote Similarity | NPD7637 | Suspended |
0.6552 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.6518 | Remote Similarity | NPD6371 | Approved |
0.6495 | Remote Similarity | NPD5209 | Approved |
0.6465 | Remote Similarity | NPD5363 | Approved |
0.6449 | Remote Similarity | NPD6648 | Approved |
0.6429 | Remote Similarity | NPD5362 | Discontinued |
0.6421 | Remote Similarity | NPD4268 | Approved |
0.6421 | Remote Similarity | NPD4271 | Approved |
0.6404 | Remote Similarity | NPD6053 | Discontinued |
0.6389 | Remote Similarity | NPD5344 | Discontinued |
0.6373 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.6373 | Remote Similarity | NPD6101 | Approved |
0.6339 | Remote Similarity | NPD6686 | Approved |
0.6327 | Remote Similarity | NPD4270 | Approved |
0.6327 | Remote Similarity | NPD4269 | Approved |
0.6316 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6263 | Remote Similarity | NPD5331 | Approved |
0.6263 | Remote Similarity | NPD5332 | Approved |
0.625 | Remote Similarity | NPD8513 | Phase 3 |
0.625 | Remote Similarity | NPD8515 | Approved |
0.625 | Remote Similarity | NPD6411 | Approved |
0.625 | Remote Similarity | NPD8516 | Approved |
0.625 | Remote Similarity | NPD8517 | Approved |
0.6238 | Remote Similarity | NPD5786 | Approved |
0.6224 | Remote Similarity | NPD5369 | Approved |
0.6224 | Remote Similarity | NPD4790 | Discontinued |
0.6214 | Remote Similarity | NPD1695 | Approved |
0.62 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6186 | Remote Similarity | NPD7505 | Discontinued |
0.6162 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.6147 | Remote Similarity | NPD7639 | Approved |
0.6147 | Remote Similarity | NPD7640 | Approved |
0.6146 | Remote Similarity | NPD4756 | Discovery |
0.6122 | Remote Similarity | NPD4252 | Approved |
0.6116 | Remote Similarity | NPD7503 | Approved |
0.61 | Remote Similarity | NPD6695 | Phase 3 |
0.6055 | Remote Similarity | NPD7638 | Approved |
0.605 | Remote Similarity | NPD7115 | Discovery |
0.6 | Remote Similarity | NPD7327 | Approved |
0.6 | Remote Similarity | NPD6435 | Approved |
0.6 | Remote Similarity | NPD7328 | Approved |
0.6 | Remote Similarity | NPD8074 | Phase 3 |
0.5984 | Remote Similarity | NPD8033 | Approved |
0.598 | Remote Similarity | NPD1694 | Approved |
0.598 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.595 | Remote Similarity | NPD7516 | Approved |
0.5918 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5906 | Remote Similarity | NPD7319 | Approved |
0.5905 | Remote Similarity | NPD5370 | Suspended |
0.5902 | Remote Similarity | NPD8377 | Approved |
0.5902 | Remote Similarity | NPD8294 | Approved |
0.5865 | Remote Similarity | NPD7524 | Approved |
0.5865 | Remote Similarity | NPD7750 | Discontinued |
0.5862 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.5854 | Remote Similarity | NPD8380 | Approved |
0.5854 | Remote Similarity | NPD8378 | Approved |
0.5854 | Remote Similarity | NPD8379 | Approved |
0.5854 | Remote Similarity | NPD8296 | Approved |
0.5854 | Remote Similarity | NPD8335 | Approved |
0.58 | Remote Similarity | NPD5368 | Approved |
0.58 | Remote Similarity | NPD6930 | Phase 2 |
0.58 | Remote Similarity | NPD6931 | Approved |
0.5794 | Remote Similarity | NPD7507 | Approved |
0.5794 | Remote Similarity | NPD4810 | Clinical (unspecified phase) |
0.5773 | Remote Similarity | NPD8039 | Approved |
0.576 | Remote Similarity | NPD7830 | Approved |
0.576 | Remote Similarity | NPD7829 | Approved |
0.5752 | Remote Similarity | NPD7632 | Discontinued |
0.5739 | Remote Similarity | NPD4211 | Phase 1 |
0.573 | Remote Similarity | NPD4246 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD7966 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD969 | Suspended |
0.5702 | Remote Similarity | NPD6647 | Phase 2 |
0.57 | Remote Similarity | NPD6929 | Approved |
0.568 | Remote Similarity | NPD8080 | Discontinued |
0.5678 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.5678 | Remote Similarity | NPD2067 | Discontinued |
0.5676 | Remote Similarity | NPD6083 | Phase 2 |
0.5676 | Remote Similarity | NPD6084 | Phase 2 |
0.5673 | Remote Similarity | NPD1696 | Phase 3 |
0.567 | Remote Similarity | NPD6926 | Approved |
0.567 | Remote Similarity | NPD6924 | Approved |
0.5669 | Remote Similarity | NPD8273 | Phase 1 |
0.5669 | Remote Similarity | NPD8451 | Approved |
0.5667 | Remote Similarity | NPD368 | Approved |
0.5656 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5656 | Remote Similarity | NPD7500 | Approved |
0.5648 | Remote Similarity | NPD7087 | Discontinued |
0.5644 | Remote Similarity | NPD7514 | Phase 3 |
0.5644 | Remote Similarity | NPD7332 | Phase 2 |
0.5641 | Remote Similarity | NPD7320 | Approved |
0.5636 | Remote Similarity | NPD5695 | Phase 3 |
0.5635 | Remote Similarity | NPD7642 | Approved |
0.563 | Remote Similarity | NPD7116 | Clinical (unspecified phase) |
0.563 | Remote Similarity | NPD2204 | Approved |
0.5625 | Remote Similarity | NPD8448 | Approved |
0.5607 | Remote Similarity | NPD6051 | Approved |
0.5603 | Remote Similarity | NPD5739 | Approved |
0.5603 | Remote Similarity | NPD6402 | Approved |
0.5603 | Remote Similarity | NPD7128 | Approved |
0.5603 | Remote Similarity | NPD6675 | Approved |
0.56 | Remote Similarity | NPD8444 | Approved |
0.56 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
PubChem CID   | 70696890 |
ChEMBL   | CHEMBL2062869 |
ZINC   |
Molecular Weight:   | 338.14 |
ALogP:   | -0.657 |
MLogP:   | 2.56 |
XLogP:   | 0.581 |
# Rotatable Bonds:   | 8 |
Polar Surface Area:   | 102.29 |
# H-Bond Aceptor:   | 7 |
# H-Bond Donor:   | 2 |
# Rings:   | 3 |
# Heavy Atoms:   | 24 |