Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO3118 | Murraya euchrestifolia | Species | Rutaceae | Eukaryota | Root barks | Kuantaochi, Nantou Hsien, Taiwan |
PMID[10924160] |
|
NPO28744 | Murraya crenulata | Species | Rutaceae | Eukaryota | TCM_Taiwan* | |||
NPO28744 | Murraya crenulata | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO3118 | Murraya euchrestifolia | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO3364 | Murraya koenigii | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO6724 | Glycosmis stenocarpa | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO16307 | Murraya kwangsiensis | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO6724 | Glycosmis stenocarpa | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO3364 | Murraya koenigii | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO3118 | Murraya euchrestifolia | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO28744 | Murraya crenulata | Species | Rutaceae | Eukaryota | TCMID* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | = | 15488.17 | nM | 10924160 |
NPT2 | Others | Unspecified | GI50 | = | 6918.31 | nM | 10924160 | |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | = | 25118.86 | nM | 10924160 |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | = | 2.512 | nM | 10924160 |
NPT2 | Others | Unspecified | GI50 | = | 8709.64 | nM | 10924160 | |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | = | 10232.93 | nM | 10924160 |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | = | 1148.15 | nM | 10924160 |
NPT732 | Cell Line | HOP-18 | Homo sapiens | GI50 | = | 288.4 | nM | 10924160 |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | = | 6309.57 | nM | 10924160 |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | = | 23442.29 | nM | 10924160 |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | = | 8511.38 | nM | 10924160 |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | = | 12882.5 | nM | 10924160 |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | = | 7762.47 | nM | 10924160 |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | = | 4265.8 | nM | 10924160 |
NPT2 | Others | Unspecified | GI50 | = | 18197.01 | nM | 10924160 | |
NPT2 | Others | Unspecified | GI50 | = | 9549.93 | nM | 10924160 | |
NPT572 | Cell Line | DMS-273 | Homo sapiens | GI50 | = | 7762.47 | nM | 10924160 |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | = | 12302.69 | nM | 10924160 |
NPT579 | Cell Line | DLD-1 | Homo sapiens | GI50 | = | 10471.29 | nM | 10924160 |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | = | 14791.08 | nM | 10924160 |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | = | 11481.54 | nM | 10924160 |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | = | 7413.1 | nM | 10924160 |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | = | 7762.47 | nM | 10924160 |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | = | 8128.31 | nM | 10924160 |
NPT575 | Cell Line | KM-20L2 | Homo sapiens | GI50 | = | 7585.78 | nM | 10924160 |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | = | 8317.64 | nM | 10924160 |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | = | 14454.4 | nM | 10924160 |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | = | 6025.6 | nM | 10924160 |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | = | 25118.86 | nM | 10924160 |
NPT392 | Cell Line | SNB-75 | Homo sapiens | GI50 | = | 25118.86 | nM | 10924160 |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | = | 10471.29 | nM | 10924160 |
NPT574 | Cell Line | XF498 | Homo sapiens | GI50 | = | 22387.21 | nM | 10924160 |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | = | 12589.25 | nM | 10924160 |
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | = | 8128.31 | nM | 10924160 |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | = | 7244.36 | nM | 10924160 |
NPT573 | Cell Line | M19-MEL | Homo sapiens | GI50 | = | 18197.01 | nM | 10924160 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | = | 7413.1 | nM | 10924160 |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | = | 16218.1 | nM | 10924160 |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | = | 9120.11 | nM | 10924160 |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | = | 15135.61 | nM | 10924160 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | = | 14791.08 | nM | 10924160 |
NPT2 | Others | Unspecified | GI50 | = | 8912.51 | nM | 10924160 | |
NPT2 | Others | Unspecified | GI50 | = | 25118.86 | nM | 10924160 | |
NPT2 | Others | Unspecified | GI50 | = | 24547.09 | nM | 10924160 | |
NPT2 | Others | Unspecified | GI50 | = | 7413.1 | nM | 10924160 | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | = | 20892.96 | nM | 10924160 |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | = | 9332.54 | nM | 10924160 |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | = | 23442.29 | nM | 10924160 |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | = | 9332.54 | nM | 10924160 |
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | = | 14125.38 | nM | 10924160 |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | = | 25118.86 | nM | 10924160 |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | = | 15135.61 | nM | 10924160 |
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | 14125.38 | nM | PubChem BioAssay data set | |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | 23388.37 | nM | PubChem BioAssay data set | |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | 15031.42 | nM | PubChem BioAssay data set | |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | 23550.49 | nM | PubChem BioAssay data set | |
NPT116 | Cell Line | HL-60 | Homo sapiens | GI50 | 6886.52 | nM | PubChem BioAssay data set | |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | 6011.74 | nM | PubChem BioAssay data set | |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | 9183.33 | nM | PubChem BioAssay data set | |
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | 8109.61 | nM | PubChem BioAssay data set | |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | 25003.45 | nM | PubChem BioAssay data set | |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | GI50 | 8912.51 | nM | PubChem BioAssay data set | |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | 2.5 | nM | PubChem BioAssay data set | |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | 6531.31 | nM | PubChem BioAssay data set | |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | 10399.2 | nM | PubChem BioAssay data set | |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | 7328.25 | nM | PubChem BioAssay data set | |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | 24490.63 | nM | PubChem BioAssay data set | |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | 25003.45 | nM | PubChem BioAssay data set | |
NPT572 | Cell Line | DMS-273 | Homo sapiens | GI50 | 7726.81 | nM | PubChem BioAssay data set | |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | 10280.16 | nM | PubChem BioAssay data set | |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | 25003.45 | nM | PubChem BioAssay data set | |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | 8356.03 | nM | PubChem BioAssay data set | |
NPT573 | Cell Line | M19-MEL | Homo sapiens | GI50 | 18323.14 | nM | PubChem BioAssay data set | |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | 4246.2 | nM | PubChem BioAssay data set | |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | 7244.36 | nM | PubChem BioAssay data set | |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | 8128.31 | nM | PubChem BioAssay data set | |
NPT574 | Cell Line | XF498 | Homo sapiens | GI50 | 22646.44 | nM | PubChem BioAssay data set | |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | 13031.67 | nM | PubChem BioAssay data set | |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | GI50 | 8649.68 | nM | PubChem BioAssay data set | |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | 25003.45 | nM | PubChem BioAssay data set | |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | 12705.74 | nM | PubChem BioAssay data set | |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | 7328.25 | nM | PubChem BioAssay data set | |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | 11481.54 | nM | PubChem BioAssay data set | |
NPT575 | Cell Line | KM-20L2 | Homo sapiens | GI50 | 7533.56 | nM | PubChem BioAssay data set | |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | 14927.94 | nM | PubChem BioAssay data set | |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | 7447.32 | nM | PubChem BioAssay data set | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | 11402.5 | nM | PubChem BioAssay data set | |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | 14354.89 | nM | PubChem BioAssay data set | |
NPT731 | Cell Line | LXFL 529 | Homo sapiens | GI50 | 18323.14 | nM | PubChem BioAssay data set | |
NPT576 | Cell Line | DMS-114 | Homo sapiens | GI50 | 9638.29 | nM | PubChem BioAssay data set | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | 20844.91 | nM | PubChem BioAssay data set | |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | 15031.42 | nM | PubChem BioAssay data set | |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | 7834.3 | nM | PubChem BioAssay data set | |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | 14791.08 | nM | PubChem BioAssay data set | |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | 9375.62 | nM | PubChem BioAssay data set | |
NPT578 | Cell Line | SNB-78 | Homo sapiens | GI50 | 25003.45 | nM | PubChem BioAssay data set | |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | 15346.17 | nM | PubChem BioAssay data set | |
NPT579 | Cell Line | DLD-1 | Homo sapiens | GI50 | 10543.87 | nM | PubChem BioAssay data set | |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | 8452.79 | nM | PubChem BioAssay data set | |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | 7780.37 | nM | PubChem BioAssay data set | |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | 16292.96 | nM | PubChem BioAssay data set | |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | 12416.52 | nM | PubChem BioAssay data set | |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | 9162.2 | nM | PubChem BioAssay data set | |
NPT732 | Cell Line | HOP-18 | Homo sapiens | GI50 | 289.73 | nM | 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 NPC242928 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 |
---|---|---|
0.9641 | High Similarity | NPC474798 |
0.9489 | High Similarity | NPC128823 |
0.9027 | High Similarity | NPC473181 |
0.8989 | High Similarity | NPC475190 |
0.8978 | High Similarity | NPC199667 |
0.893 | High Similarity | NPC187501 |
0.8883 | High Similarity | NPC94157 |
0.8883 | High Similarity | NPC473180 |
0.8836 | High Similarity | NPC39500 |
0.8833 | High Similarity | NPC131017 |
0.8811 | High Similarity | NPC470930 |
0.8698 | High Similarity | NPC118511 |
0.8693 | High Similarity | NPC176127 |
0.8656 | High Similarity | NPC245816 |
0.8656 | High Similarity | NPC476138 |
0.8653 | High Similarity | NPC184408 |
0.8608 | High Similarity | NPC473179 |
0.8608 | High Similarity | NPC208084 |
0.8564 | High Similarity | NPC132642 |
0.8564 | High Similarity | NPC225279 |
0.8533 | High Similarity | NPC70956 |
0.8533 | High Similarity | NPC243834 |
0.8523 | High Similarity | NPC88363 |
0.8486 | Intermediate Similarity | NPC72211 |
0.8478 | Intermediate Similarity | NPC70259 |
0.8477 | Intermediate Similarity | NPC144452 |
0.8457 | Intermediate Similarity | NPC162484 |
0.8436 | Intermediate Similarity | NPC84478 |
0.8429 | Intermediate Similarity | NPC209769 |
0.8424 | Intermediate Similarity | NPC205934 |
0.8424 | Intermediate Similarity | NPC43787 |
0.8368 | Intermediate Similarity | NPC45190 |
0.8368 | Intermediate Similarity | NPC300156 |
0.8325 | Intermediate Similarity | NPC193777 |
0.8308 | Intermediate Similarity | NPC473185 |
0.8308 | Intermediate Similarity | NPC118228 |
0.83 | Intermediate Similarity | NPC179287 |
0.8267 | Intermediate Similarity | NPC274640 |
0.8254 | Intermediate Similarity | NPC267423 |
0.8251 | Intermediate Similarity | NPC296527 |
0.8238 | Intermediate Similarity | NPC185782 |
0.8211 | Intermediate Similarity | NPC475085 |
0.8211 | Intermediate Similarity | NPC291535 |
0.8211 | Intermediate Similarity | NPC475112 |
0.8207 | Intermediate Similarity | NPC76748 |
0.8201 | Intermediate Similarity | NPC329793 |
0.8201 | Intermediate Similarity | NPC19872 |
0.8187 | Intermediate Similarity | NPC42591 |
0.8186 | Intermediate Similarity | NPC475253 |
0.8186 | Intermediate Similarity | NPC474688 |
0.8177 | Intermediate Similarity | NPC212535 |
0.8163 | Intermediate Similarity | NPC476287 |
0.8162 | Intermediate Similarity | NPC92111 |
0.8158 | Intermediate Similarity | NPC476044 |
0.8154 | Intermediate Similarity | NPC208284 |
0.8152 | Intermediate Similarity | NPC246700 |
0.8146 | Intermediate Similarity | NPC473186 |
0.8144 | Intermediate Similarity | NPC201697 |
0.8135 | Intermediate Similarity | NPC249583 |
0.8135 | Intermediate Similarity | NPC4687 |
0.8135 | Intermediate Similarity | NPC283117 |
0.8115 | Intermediate Similarity | NPC199277 |
0.8115 | Intermediate Similarity | NPC135887 |
0.8112 | Intermediate Similarity | NPC26679 |
0.8107 | Intermediate Similarity | NPC473182 |
0.8105 | Intermediate Similarity | NPC176538 |
0.8105 | Intermediate Similarity | NPC329747 |
0.8087 | Intermediate Similarity | NPC94943 |
0.8085 | Intermediate Similarity | NPC251090 |
0.8083 | Intermediate Similarity | NPC476106 |
0.8075 | Intermediate Similarity | NPC307963 |
0.8073 | Intermediate Similarity | NPC475774 |
0.8073 | Intermediate Similarity | NPC223427 |
0.8068 | Intermediate Similarity | NPC39370 |
0.8066 | Intermediate Similarity | NPC478032 |
0.8035 | Intermediate Similarity | NPC26850 |
0.8033 | Intermediate Similarity | NPC190007 |
0.802 | Intermediate Similarity | NPC48353 |
0.799 | Intermediate Similarity | NPC473183 |
0.799 | Intermediate Similarity | NPC470799 |
0.799 | Intermediate Similarity | NPC8022 |
0.7981 | Intermediate Similarity | NPC473184 |
0.798 | Intermediate Similarity | NPC51388 |
0.797 | Intermediate Similarity | NPC87413 |
0.797 | Intermediate Similarity | NPC294375 |
0.7965 | Intermediate Similarity | NPC26872 |
0.796 | Intermediate Similarity | NPC292958 |
0.7957 | Intermediate Similarity | NPC128751 |
0.7929 | Intermediate Similarity | NPC308137 |
0.7929 | Intermediate Similarity | NPC310211 |
0.7919 | Intermediate Similarity | NPC471304 |
0.7914 | Intermediate Similarity | NPC469497 |
0.7914 | Intermediate Similarity | NPC106833 |
0.791 | Intermediate Similarity | NPC46561 |
0.7902 | Intermediate Similarity | NPC202503 |
0.7889 | Intermediate Similarity | NPC474409 |
0.7877 | Intermediate Similarity | NPC475844 |
0.7876 | Intermediate Similarity | NPC232727 |
0.7865 | Intermediate Similarity | NPC476167 |
0.7861 | Intermediate Similarity | NPC293151 |
0.7853 | Intermediate Similarity | NPC153042 |
0.785 | Intermediate Similarity | NPC116238 |
0.7846 | Intermediate Similarity | NPC285558 |
0.7845 | Intermediate Similarity | NPC312872 |
0.7812 | Intermediate Similarity | NPC192315 |
0.7801 | Intermediate Similarity | NPC13880 |
0.7799 | Intermediate Similarity | NPC101543 |
0.7799 | Intermediate Similarity | NPC469554 |
0.7796 | Intermediate Similarity | NPC473189 |
0.7794 | Intermediate Similarity | NPC280799 |
0.7772 | Intermediate Similarity | NPC169402 |
0.7772 | Intermediate Similarity | NPC18487 |
0.7766 | Intermediate Similarity | NPC321428 |
0.7754 | Intermediate Similarity | NPC160381 |
0.7751 | Intermediate Similarity | NPC474701 |
0.7745 | Intermediate Similarity | NPC86078 |
0.7734 | Intermediate Similarity | NPC247803 |
0.773 | Intermediate Similarity | NPC206201 |
0.7727 | Intermediate Similarity | NPC39679 |
0.7727 | Intermediate Similarity | NPC475910 |
0.7717 | Intermediate Similarity | NPC72980 |
0.7711 | Intermediate Similarity | NPC478074 |
0.7696 | Intermediate Similarity | NPC288987 |
0.7685 | Intermediate Similarity | NPC314552 |
0.7678 | Intermediate Similarity | NPC180504 |
0.7673 | Intermediate Similarity | NPC470549 |
0.767 | Intermediate Similarity | NPC141353 |
0.7668 | Intermediate Similarity | NPC267928 |
0.766 | Intermediate Similarity | NPC204385 |
0.7659 | Intermediate Similarity | NPC150239 |
0.7659 | Intermediate Similarity | NPC174760 |
0.765 | Intermediate Similarity | NPC123976 |
0.765 | Intermediate Similarity | NPC167860 |
0.7647 | Intermediate Similarity | NPC96321 |
0.7641 | Intermediate Similarity | NPC11017 |
0.7635 | Intermediate Similarity | NPC170114 |
0.7624 | Intermediate Similarity | NPC266931 |
0.7621 | Intermediate Similarity | NPC477532 |
0.7621 | Intermediate Similarity | NPC198503 |
0.7573 | Intermediate Similarity | NPC477533 |
0.7571 | Intermediate Similarity | NPC252251 |
0.756 | Intermediate Similarity | NPC227908 |
0.7553 | Intermediate Similarity | NPC284678 |
0.7553 | Intermediate Similarity | NPC204717 |
0.755 | Intermediate Similarity | NPC476465 |
0.7538 | Intermediate Similarity | NPC304183 |
0.7537 | Intermediate Similarity | NPC471080 |
0.7537 | Intermediate Similarity | NPC469592 |
0.7514 | Intermediate Similarity | NPC224764 |
0.7513 | Intermediate Similarity | NPC314002 |
0.75 | Intermediate Similarity | NPC177404 |
0.75 | Intermediate Similarity | NPC220765 |
0.75 | Intermediate Similarity | NPC477531 |
0.7488 | Intermediate Similarity | NPC314954 |
0.7477 | Intermediate Similarity | NPC24802 |
0.7476 | Intermediate Similarity | NPC473041 |
0.7475 | Intermediate Similarity | NPC11464 |
0.7474 | Intermediate Similarity | NPC171171 |
0.7463 | Intermediate Similarity | NPC470931 |
0.7463 | Intermediate Similarity | NPC3207 |
0.7463 | Intermediate Similarity | NPC477111 |
0.7462 | Intermediate Similarity | NPC121772 |
0.7461 | Intermediate Similarity | NPC99666 |
0.7453 | Intermediate Similarity | NPC209174 |
0.745 | Intermediate Similarity | NPC477113 |
0.7441 | Intermediate Similarity | NPC257851 |
0.7438 | Intermediate Similarity | NPC9894 |
0.7435 | Intermediate Similarity | NPC66083 |
0.7433 | Intermediate Similarity | NPC42979 |
0.7432 | Intermediate Similarity | NPC1527 |
0.7425 | Intermediate Similarity | NPC179365 |
0.7419 | Intermediate Similarity | NPC56618 |
0.7416 | Intermediate Similarity | NPC280272 |
0.7405 | Intermediate Similarity | NPC34508 |
0.7402 | Intermediate Similarity | NPC316981 |
0.7393 | Intermediate Similarity | NPC200888 |
0.7393 | Intermediate Similarity | NPC470018 |
0.7391 | Intermediate Similarity | NPC469594 |
0.7391 | Intermediate Similarity | NPC303658 |
0.7387 | Intermediate Similarity | NPC66815 |
0.7385 | Intermediate Similarity | NPC276517 |
0.7383 | Intermediate Similarity | NPC49547 |
0.738 | Intermediate Similarity | NPC184964 |
0.738 | Intermediate Similarity | NPC283152 |
0.7374 | Intermediate Similarity | NPC234197 |
0.7358 | Intermediate Similarity | NPC74575 |
0.7356 | Intermediate Similarity | NPC193267 |
0.7356 | Intermediate Similarity | NPC213530 |
0.7354 | Intermediate Similarity | NPC314394 |
0.7333 | Intermediate Similarity | NPC230403 |
0.7327 | Intermediate Similarity | NPC6786 |
0.7326 | Intermediate Similarity | NPC288943 |
0.731 | Intermediate Similarity | NPC77555 |
0.7308 | Intermediate Similarity | NPC16667 |
0.7305 | Intermediate Similarity | NPC473587 |
0.7304 | Intermediate Similarity | NPC5145 |
0.7297 | Intermediate Similarity | NPC314940 |
0.7297 | Intermediate Similarity | NPC473764 |
0.7295 | Intermediate Similarity | NPC477110 |
0.7295 | Intermediate Similarity | NPC288349 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC242928 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 |
---|---|---|---|
0.8384 | Intermediate Similarity | NPD6160 | Clinical (unspecified phase) |
0.8342 | Intermediate Similarity | NPD4118 | Clinical (unspecified phase) |
0.8172 | Intermediate Similarity | NPD1304 | Clinical (unspecified phase) |
0.8128 | Intermediate Similarity | NPD3324 | Clinical (unspecified phase) |
0.8075 | Intermediate Similarity | NPD1038 | Approved |
0.7935 | Intermediate Similarity | NPD5083 | Clinical (unspecified phase) |
0.7908 | Intermediate Similarity | NPD5658 | Approved |
0.7897 | Intermediate Similarity | NPD3003 | Approved |
0.7865 | Intermediate Similarity | NPD3825 | Phase 3 |
0.7789 | Intermediate Similarity | NPD4502 | Phase 2 |
0.7778 | Intermediate Similarity | NPD5912 | Clinical (unspecified phase) |
0.7778 | Intermediate Similarity | NPD5913 | Phase 3 |
0.7685 | Intermediate Similarity | NPD5164 | Discontinued |
0.768 | Intermediate Similarity | NPD1768 | Approved |
0.768 | Intermediate Similarity | NPD1326 | Approved |
0.768 | Intermediate Similarity | NPD1325 | Approved |
0.7673 | Intermediate Similarity | NPD5903 | Approved |
0.7673 | Intermediate Similarity | NPD5902 | Approved |
0.766 | Intermediate Similarity | NPD5256 | Discontinued |
0.7656 | Intermediate Similarity | NPD4418 | Discontinued |
0.7635 | Intermediate Similarity | NPD5612 | Discontinued |
0.7622 | Intermediate Similarity | NPD3920 | Phase 2 |
0.7588 | Intermediate Similarity | NPD7452 | Approved |
0.7588 | Intermediate Similarity | NPD7222 | Phase 2 |
0.7588 | Intermediate Similarity | NPD7453 | Approved |
0.755 | Intermediate Similarity | NPD2187 | Approved |
0.755 | Intermediate Similarity | NPD2189 | Approved |
0.7542 | Intermediate Similarity | NPD112 | Approved |
0.7542 | Intermediate Similarity | NPD9705 | Discontinued |
0.7525 | Intermediate Similarity | NPD5067 | Phase 2 |
0.7525 | Intermediate Similarity | NPD5066 | Phase 2 |
0.7513 | Intermediate Similarity | NPD4511 | Phase 1 |
0.7488 | Intermediate Similarity | NPD5559 | Phase 2 |
0.7487 | Intermediate Similarity | NPD5003 | Discontinued |
0.7474 | Intermediate Similarity | NPD6590 | Discontinued |
0.745 | Intermediate Similarity | NPD8403 | Phase 1 |
0.744 | Intermediate Similarity | NPD3402 | Phase 1 |
0.7438 | Intermediate Similarity | NPD5939 | Approved |
0.7438 | Intermediate Similarity | NPD5936 | Approved |
0.7436 | Intermediate Similarity | NPD5512 | Phase 3 |
0.7423 | Intermediate Similarity | NPD5575 | Clinical (unspecified phase) |
0.7413 | Intermediate Similarity | NPD1392 | Approved |
0.7413 | Intermediate Similarity | NPD5429 | Discontinued |
0.7411 | Intermediate Similarity | NPD2175 | Phase 3 |
0.7411 | Intermediate Similarity | NPD2176 | Approved |
0.7411 | Intermediate Similarity | NPD2177 | Approved |
0.7404 | Intermediate Similarity | NPD6242 | Discontinued |
0.7391 | Intermediate Similarity | NPD6985 | Discontinued |
0.7391 | Intermediate Similarity | NPD5632 | Approved |
0.7391 | Intermediate Similarity | NPD4429 | Discontinued |
0.7361 | Intermediate Similarity | NPD4454 | Phase 2 |
0.7358 | Intermediate Similarity | NPD2564 | Approved |
0.7358 | Intermediate Similarity | NPD2565 | Phase 2 |
0.7356 | Intermediate Similarity | NPD3875 | Discontinued |
0.7353 | Intermediate Similarity | NPD6220 | Phase 3 |
0.7347 | Intermediate Similarity | NPD6550 | Discontinued |
0.7345 | Intermediate Similarity | NPD3833 | Phase 3 |
0.7345 | Intermediate Similarity | NPD3835 | Phase 3 |
0.7343 | Intermediate Similarity | NPD7823 | Clinical (unspecified phase) |
0.7323 | Intermediate Similarity | NPD4548 | Discontinued |
0.7313 | Intermediate Similarity | NPD4795 | Phase 2 |
0.73 | Intermediate Similarity | NPD5669 | Clinical (unspecified phase) |
0.7296 | Intermediate Similarity | NPD6861 | Clinical (unspecified phase) |
0.7296 | Intermediate Similarity | NPD6251 | Discontinued |
0.7286 | Intermediate Similarity | NPD1739 | Approved |
0.7286 | Intermediate Similarity | NPD1740 | Approved |
0.7282 | Intermediate Similarity | NPD1322 | Clinical (unspecified phase) |
0.7273 | Intermediate Similarity | NPD3514 | Clinical (unspecified phase) |
0.7273 | Intermediate Similarity | NPD7194 | Discontinued |
0.7263 | Intermediate Similarity | NPD4203 | Approved |
0.7263 | Intermediate Similarity | NPD4204 | Approved |
0.7246 | Intermediate Similarity | NPD6140 | Clinical (unspecified phase) |
0.7241 | Intermediate Similarity | NPD6290 | Phase 2 |
0.724 | Intermediate Similarity | NPD6344 | Clinical (unspecified phase) |
0.7238 | Intermediate Similarity | NPD7678 | Clinical (unspecified phase) |
0.7236 | Intermediate Similarity | NPD5999 | Phase 2 |
0.7222 | Intermediate Similarity | NPD7948 | Phase 1 |
0.7222 | Intermediate Similarity | NPD6988 | Phase 1 |
0.722 | Intermediate Similarity | NPD1166 | Clinical (unspecified phase) |
0.7216 | Intermediate Similarity | NPD1305 | Clinical (unspecified phase) |
0.7208 | Intermediate Similarity | NPD6491 | Clinical (unspecified phase) |
0.7198 | Intermediate Similarity | NPD3945 | Discontinued |
0.7196 | Intermediate Similarity | NPD6159 | Phase 2 |
0.7194 | Intermediate Similarity | NPD3923 | Approved |
0.7194 | Intermediate Similarity | NPD3922 | Approved |
0.7194 | Intermediate Similarity | NPD3924 | Approved |
0.7194 | Intermediate Similarity | NPD3921 | Approved |
0.7192 | Intermediate Similarity | NPD3842 | Clinical (unspecified phase) |
0.7192 | Intermediate Similarity | NPD5530 | Phase 1 |
0.7189 | Intermediate Similarity | NPD6741 | Clinical (unspecified phase) |
0.7172 | Intermediate Similarity | NPD3478 | Clinical (unspecified phase) |
0.7172 | Intermediate Similarity | NPD3477 | Phase 2 |
0.7171 | Intermediate Similarity | NPD2125 | Clinical (unspecified phase) |
0.715 | Intermediate Similarity | NPD8396 | Approved |
0.715 | Intermediate Similarity | NPD8395 | Approved |
0.7143 | Intermediate Similarity | NPD4354 | Approved |
0.7143 | Intermediate Similarity | NPD4885 | Approved |
0.713 | Intermediate Similarity | NPD5483 | Clinical (unspecified phase) |
0.713 | Intermediate Similarity | NPD5479 | Discontinued |
0.7129 | Intermediate Similarity | NPD6643 | Discontinued |
0.7124 | Intermediate Similarity | NPD6503 | Clinical (unspecified phase) |
0.7123 | Intermediate Similarity | NPD3006 | Discontinued |
0.7112 | Intermediate Similarity | NPD4724 | Clinical (unspecified phase) |
0.7108 | Intermediate Similarity | NPD6150 | Discontinued |
0.709 | Intermediate Similarity | NPD9690 | Approved |
0.7089 | Intermediate Similarity | NPD6824 | Clinical (unspecified phase) |
0.7081 | Intermediate Similarity | NPD5417 | Clinical (unspecified phase) |
0.7081 | Intermediate Similarity | NPD3257 | Approved |
0.7077 | Intermediate Similarity | NPD2749 | Discontinued |
0.7074 | Intermediate Similarity | NPD5680 | Clinical (unspecified phase) |
0.7071 | Intermediate Similarity | NPD802 | Phase 2 |
0.7067 | Intermediate Similarity | NPD4927 | Discontinued |
0.7051 | Intermediate Similarity | NPD5022 | Discontinued |
0.7048 | Intermediate Similarity | NPD6147 | Clinical (unspecified phase) |
0.7047 | Intermediate Similarity | NPD5522 | Clinical (unspecified phase) |
0.7045 | Intermediate Similarity | NPD3834 | Clinical (unspecified phase) |
0.7045 | Intermediate Similarity | NPD1592 | Phase 3 |
0.7035 | Intermediate Similarity | NPD3791 | Clinical (unspecified phase) |
0.7035 | Intermediate Similarity | NPD3810 | Clinical (unspecified phase) |
0.7032 | Intermediate Similarity | NPD7558 | Phase 2 |
0.703 | Intermediate Similarity | NPD484 | Approved |
0.7027 | Intermediate Similarity | NPD2921 | Clinical (unspecified phase) |
0.7024 | Intermediate Similarity | NPD4862 | Clinical (unspecified phase) |
0.7021 | Intermediate Similarity | NPD565 | Phase 2 |
0.702 | Intermediate Similarity | NPD6569 | Phase 2 |
0.7019 | Intermediate Similarity | NPD5416 | Discontinued |
0.7009 | Intermediate Similarity | NPD6736 | Discontinued |
0.7005 | Intermediate Similarity | NPD7555 | Discontinued |
0.6995 | Remote Similarity | NPD5930 | Phase 3 |
0.6991 | Remote Similarity | NPD7603 | Discontinued |
0.699 | Remote Similarity | NPD6141 | Clinical (unspecified phase) |
0.699 | Remote Similarity | NPD1034 | Phase 3 |
0.699 | Remote Similarity | NPD1033 | Clinical (unspecified phase) |
0.6986 | Remote Similarity | NPD6202 | Discontinued |
0.6986 | Remote Similarity | NPD3330 | Phase 1 |
0.6984 | Remote Similarity | NPD1078 | Clinical (unspecified phase) |
0.6981 | Remote Similarity | NPD8109 | Clinical (unspecified phase) |
0.6981 | Remote Similarity | NPD7395 | Discontinued |
0.6976 | Remote Similarity | NPD4035 | Approved |
0.6976 | Remote Similarity | NPD4039 | Approved |
0.6976 | Remote Similarity | NPD4037 | Approved |
0.6976 | Remote Similarity | NPD31 | Approved |
0.6976 | Remote Similarity | NPD4034 | Approved |
0.6976 | Remote Similarity | NPD4036 | Approved |
0.6976 | Remote Similarity | NPD4033 | Approved |
0.6976 | Remote Similarity | NPD32 | Approved |
0.6976 | Remote Similarity | NPD4122 | Approved |
0.6976 | Remote Similarity | NPD4038 | Approved |
0.6976 | Remote Similarity | NPD3397 | Phase 2 |
0.6967 | Remote Similarity | NPD2433 | Clinical (unspecified phase) |
0.6965 | Remote Similarity | NPD6769 | Clinical (unspecified phase) |
0.6961 | Remote Similarity | NPD6208 | Discontinued |
0.6948 | Remote Similarity | NPD3258 | Approved |
0.6947 | Remote Similarity | NPD6607 | Clinical (unspecified phase) |
0.6944 | Remote Similarity | NPD4890 | Phase 2 |
0.6942 | Remote Similarity | NPD4305 | Clinical (unspecified phase) |
0.6935 | Remote Similarity | NPD972 | Clinical (unspecified phase) |
0.6935 | Remote Similarity | NPD1685 | Approved |
0.6935 | Remote Similarity | NPD1684 | Approved |
0.6934 | Remote Similarity | NPD3440 | Clinical (unspecified phase) |
0.693 | Remote Similarity | NPD1856 | Discontinued |
0.693 | Remote Similarity | NPD2285 | Clinical (unspecified phase) |
0.6927 | Remote Similarity | NPD7710 | Clinical (unspecified phase) |
0.6927 | Remote Similarity | NPD2920 | Discontinued |
0.6923 | Remote Similarity | NPD2951 | Discontinued |
0.6916 | Remote Similarity | NPD8358 | Approved |
0.6911 | Remote Similarity | NPD5065 | Approved |
0.6909 | Remote Similarity | NPD3746 | Discontinued |
0.6905 | Remote Similarity | NPD3816 | Phase 1 |
0.6905 | Remote Similarity | NPD3815 | Phase 1 |
0.6904 | Remote Similarity | NPD2383 | Phase 1 |
0.6901 | Remote Similarity | NPD3354 | Phase 2 |
0.6897 | Remote Similarity | NPD2778 | Approved |
0.6897 | Remote Similarity | NPD3814 | Phase 1 |
0.6895 | Remote Similarity | NPD6969 | Phase 2 |
0.6895 | Remote Similarity | NPD6968 | Phase 2 |
0.6891 | Remote Similarity | NPD8386 | Phase 2 |
0.6888 | Remote Similarity | NPD4889 | Approved |
0.6884 | Remote Similarity | NPD4881 | Clinical (unspecified phase) |
0.6878 | Remote Similarity | NPD6494 | Phase 2 |
0.6878 | Remote Similarity | NPD1897 | Discontinued |
0.6875 | Remote Similarity | NPD7671 | Approved |
0.6875 | Remote Similarity | NPD7672 | Approved |
0.6868 | Remote Similarity | NPD4463 | Approved |
0.6868 | Remote Similarity | NPD4462 | Approved |
0.6866 | Remote Similarity | NPD6247 | Clinical (unspecified phase) |
0.6864 | Remote Similarity | NPD1867 | Approved |
0.6857 | Remote Similarity | NPD7468 | Clinical (unspecified phase) |
0.6856 | Remote Similarity | NPD5482 | Discontinued |
0.6853 | Remote Similarity | NPD4919 | Phase 3 |
0.6853 | Remote Similarity | NPD4921 | Phase 3 |
0.6853 | Remote Similarity | NPD6961 | Discontinued |
0.6853 | Remote Similarity | NPD4920 | Clinical (unspecified phase) |
0.6852 | Remote Similarity | NPD7219 | Approved |
0.6852 | Remote Similarity | NPD7221 | Approved |
0.6845 | Remote Similarity | NPD6991 | Approved |
0.6845 | Remote Similarity | NPD6324 | Phase 1 |
0.6839 | Remote Similarity | NPD3504 | Approved |
0.6839 | Remote Similarity | NPD3503 | Approved |
0.6839 | Remote Similarity | NPD4071 | Approved |
PubChem CID   | 375150 |
ChEMBL   | CHEMBL490667 |
ZINC   |
Molecular Weight:   | 211.10 |
ALogP:   | 0.1698 |
MLogP:   | 2.78 |
XLogP:   | 3.746 |
# Rotatable Bonds:   | 3 |
Polar Surface Area:   | 25.02 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 3 |
# Heavy Atoms:   | 16 |