Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO24758 | Angelica dahurica | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO18129 | Notopterygii rhizoma et radix | NA | NA | NA | TCMSP* | |||
NPO7279 | Ferulago capillaries | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO29710 | Saposhnikoviae radix | NA | NA | NA | TCMSP* | |||
NPO29700 | Peucedani radix | NA | NA | NA | TCMSP* | |||
NPO13103 | Radix angelicae biseratae | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO29661 | Glehniae radix | NA | NA | NA | TCMSP* | |||
NPO29558 | Anemarrhenae rhizoma | NA | NA | NA | TCMSP* | |||
NPO11438 | Angelica gigas | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO11438 | Angelica gigas | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO12746 | Pleurospermum rivulorum | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO17866 | Peucedanum rubricaule | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO15394 | Angelica decursiva | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO5045 | Aegle marmelos | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO17729 | Tephrosia toxicaria | Species | Geometridae | Eukaryota | HerDing* | |||
NPO2655 | Heracleum rapula | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO17866 | Peucedanum rubricaule | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO2392 | Hansenia weberbaueriana | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO17866 | Peucedanum rubricaule | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO28975 | Thamnosma rhodesica | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO23235 | Zanthoxylum arnottianum | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO12746 | Pleurospermum rivulorum | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO24205 | Peucedanum terebinthaceum | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO26741 | Anemarrhena asphodeloides | Species | Asparagaceae | Eukaryota | TCMID* | |||
NPO24758 | Angelica dahurica | Species | Apiaceae | Eukaryota | TCM_Taiwan* | |||
NPO23235 | Zanthoxylum arnottianum | Species | Rutaceae | Eukaryota | TCMID* | |||
NPO2629 | Cystoseira caespitosa | Species | Sargassaceae | Eukaryota | UNPD* | |||
NPO24758 | Angelica dahurica | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO25702 | Angelica pachycarpa | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO5495 | Broussonetia papyrifera | Species | Moraceae | Eukaryota | Whole Plants | Shawnee National Forest, Harrisburg, IL, US |
PMID[11678652] |
|
NPO25702 | Angelica pachycarpa | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO15394 | Angelica decursiva | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO8369 | Antiaris toxicaria | Species | Moraceae | Eukaryota | trunk bark | Yunnan, China |
PMID[24582402] |
|
NPO2655 | Heracleum rapula | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO24205 | Peucedanum terebinthaceum | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO1100 | Croton joufra | Species | Euphorbiaceae | Eukaryota | UNPD* | |||
NPO26741 | Anemarrhena asphodeloides | Species | Asparagaceae | Eukaryota | HerDing* | |||
NPO17729 | Tephrosia toxicaria | Species | Geometridae | Eukaryota | TCMID* | |||
NPO16614 | Zanthoxylum spinosum | Species | Rutaceae | Eukaryota | UNPD* | |||
NPO28975 | Thamnosma rhodesica | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO5495 | Broussonetia papyrifera | Species | Moraceae | Eukaryota | TCMID* | |||
NPO8067 | Pelargonium crispum | Species | Geraniaceae | Eukaryota | UNPD* | |||
NPO30526 | Notopterygium incisum | NA | NA | NA | HerDing* | |||
NPO11438 | Angelica gigas | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO24079 | Eucalyptus laevopinea | Species | Myrtaceae | Eukaryota | UNPD* | |||
NPO5045 | Aegle marmelos | Species | Rutaceae | Eukaryota | TCM_Taiwan* | |||
NPO11302 | Hymenidium lindleyanum | Species | Apiaceae | Eukaryota | TCMID* | |||
NPO1117 | Hypholoma capnoides | Species | Strophariaceae | Eukaryota | UNPD* | |||
NPO5045 | Aegle marmelos | Species | Rutaceae | Eukaryota | HerDing* | |||
NPO24248.1 | Lactarius deliciosus var. deterrimus | Varieties | Russulaceae | Eukaryota | UNPD* | |||
NPO9366 | Rosa transmorrisonensis | Species | Rosaceae | Eukaryota | UNPD* | |||
NPO5495 | Broussonetia papyrifera | Species | Moraceae | Eukaryota | HerDing* | |||
NPO3750 | Solidago missouriensis | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO7279 | Ferulago capillaries | Species | Apiaceae | Eukaryota | HerDing* | |||
NPO6128 | Hunteria eburnea | Species | Apocynaceae | Eukaryota | UNPD* | |||
NPO2921 | Angelica acutiloba | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO854 | Fucus serratus | Species | Fucaceae | Eukaryota | UNPD* | |||
NPO11438 | Angelica gigas | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO4812 | Cynometra hankei | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO15462 | Angelica sinensis | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO7614 | Laurus camphora | Species | Lauraceae | Eukaryota | UNPD* | |||
NPO8874 | Glehnia littoralis | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO1538 | Lepechinia hastata | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO16675 | Peucedanum japonicum | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO12028 | Acori tataninowii rhizoma | NA | NA | NA | TCMSP* | |||
NPO16755 | Saposhnikovia divaricata | Species | Apiaceae | Eukaryota | TM-MC* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT204 | Individual Protein | Acetylcholinesterase | Homo sapiens | IC50 | = | 67000 | nM | 11374978 |
NPT441 | Individual Protein | Cytochrome P450 19A1 | Homo sapiens | IC50 | > | 40 | ug/ml | 11678652 |
NPT740 | Individual Protein | Beta-secretase 1 | Homo sapiens | IC50 | > | 500000 | nM | 22222157 |
NPT740 | Individual Protein | Beta-secretase 1 | Homo sapiens | Inhibition | = | 2.9 | % | 22222157 |
NPT73 | Individual Protein | Solute carrier organic anion transporter family member 1B1 | Homo sapiens | Inhibition | = | 89.64 | % | 23571415 |
NPT72 | Individual Protein | Solute carrier organic anion transporter family member 1B3 | Homo sapiens | Inhibition | = | 103.86 | % | 23571415 |
NPT83 | Cell Line | MCF7 | Homo sapiens | ED50 | > | 20 | ug/ml | 24582402 |
NPT81 | Cell Line | A549 | Homo sapiens | ED50 | > | 20 | ug/ml | 24582402 |
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 NPC98179 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 |
---|---|---|
1.0 | High Similarity | NPC253574 |
0.9922 | High Similarity | NPC33986 |
0.9542 | High Similarity | NPC188380 |
0.9542 | High Similarity | NPC224543 |
0.9542 | High Similarity | NPC78746 |
0.9538 | High Similarity | NPC62366 |
0.9535 | High Similarity | NPC14248 |
0.947 | High Similarity | NPC184861 |
0.947 | High Similarity | NPC225106 |
0.947 | High Similarity | NPC281014 |
0.947 | High Similarity | NPC153818 |
0.947 | High Similarity | NPC294456 |
0.947 | High Similarity | NPC232246 |
0.947 | High Similarity | NPC212124 |
0.947 | High Similarity | NPC155963 |
0.9466 | High Similarity | NPC472525 |
0.9462 | High Similarity | NPC222036 |
0.9462 | High Similarity | NPC7526 |
0.9462 | High Similarity | NPC163557 |
0.9398 | High Similarity | NPC151946 |
0.9394 | High Similarity | NPC38099 |
0.9394 | High Similarity | NPC26954 |
0.9389 | High Similarity | NPC204353 |
0.9389 | High Similarity | NPC180716 |
0.9389 | High Similarity | NPC224475 |
0.9389 | High Similarity | NPC307412 |
0.9389 | High Similarity | NPC213173 |
0.9389 | High Similarity | NPC326600 |
0.9389 | High Similarity | NPC55149 |
0.9389 | High Similarity | NPC50896 |
0.9375 | High Similarity | NPC185066 |
0.937 | High Similarity | NPC188327 |
0.937 | High Similarity | NPC234109 |
0.9328 | High Similarity | NPC312881 |
0.9308 | High Similarity | NPC29734 |
0.9259 | High Similarity | NPC195357 |
0.9259 | High Similarity | NPC152771 |
0.9259 | High Similarity | NPC287286 |
0.9254 | High Similarity | NPC279573 |
0.9248 | High Similarity | NPC283331 |
0.9237 | High Similarity | NPC194277 |
0.9231 | High Similarity | NPC113098 |
0.9167 | High Similarity | NPC31849 |
0.9167 | High Similarity | NPC167111 |
0.9167 | High Similarity | NPC469449 |
0.9167 | High Similarity | NPC207002 |
0.9167 | High Similarity | NPC133956 |
0.9167 | High Similarity | NPC296624 |
0.9167 | High Similarity | NPC318400 |
0.9167 | High Similarity | NPC471910 |
0.916 | High Similarity | NPC267336 |
0.916 | High Similarity | NPC272650 |
0.9154 | High Similarity | NPC168710 |
0.9137 | High Similarity | NPC296377 |
0.9111 | High Similarity | NPC211110 |
0.9098 | High Similarity | NPC84894 |
0.9098 | High Similarity | NPC287182 |
0.9098 | High Similarity | NPC195343 |
0.9098 | High Similarity | NPC47163 |
0.9098 | High Similarity | NPC164269 |
0.9098 | High Similarity | NPC319859 |
0.9098 | High Similarity | NPC267412 |
0.9098 | High Similarity | NPC166672 |
0.9098 | High Similarity | NPC198381 |
0.9098 | High Similarity | NPC18804 |
0.9098 | High Similarity | NPC260265 |
0.9098 | High Similarity | NPC100986 |
0.9098 | High Similarity | NPC74655 |
0.9098 | High Similarity | NPC127888 |
0.9084 | High Similarity | NPC80170 |
0.9077 | High Similarity | NPC199204 |
0.9071 | High Similarity | NPC169510 |
0.9058 | High Similarity | NPC471824 |
0.9037 | High Similarity | NPC471068 |
0.9037 | High Similarity | NPC471069 |
0.903 | High Similarity | NPC471625 |
0.903 | High Similarity | NPC472424 |
0.903 | High Similarity | NPC471909 |
0.903 | High Similarity | NPC281241 |
0.903 | High Similarity | NPC86892 |
0.903 | High Similarity | NPC469675 |
0.8993 | High Similarity | NPC85624 |
0.8993 | High Similarity | NPC469701 |
0.8992 | High Similarity | NPC244495 |
0.8992 | High Similarity | NPC93219 |
0.8984 | High Similarity | NPC472518 |
0.8971 | High Similarity | NPC471071 |
0.8971 | High Similarity | NPC471072 |
0.8971 | High Similarity | NPC471070 |
0.8963 | High Similarity | NPC476455 |
0.8963 | High Similarity | NPC128529 |
0.8963 | High Similarity | NPC471630 |
0.8963 | High Similarity | NPC55615 |
0.8963 | High Similarity | NPC160727 |
0.8963 | High Similarity | NPC177281 |
0.8963 | High Similarity | NPC149320 |
0.8963 | High Similarity | NPC283019 |
0.8923 | High Similarity | NPC471826 |
0.8921 | High Similarity | NPC471763 |
0.8915 | High Similarity | NPC73413 |
0.8915 | High Similarity | NPC201667 |
0.8915 | High Similarity | NPC111347 |
0.8906 | High Similarity | NPC96286 |
0.8906 | High Similarity | NPC248429 |
0.8865 | High Similarity | NPC87950 |
0.8865 | High Similarity | NPC471764 |
0.8855 | High Similarity | NPC258567 |
0.8855 | High Similarity | NPC224774 |
0.8855 | High Similarity | NPC243688 |
0.8855 | High Similarity | NPC121740 |
0.8846 | High Similarity | NPC471828 |
0.8846 | High Similarity | NPC471827 |
0.8837 | High Similarity | NPC273772 |
0.8837 | High Similarity | NPC154176 |
0.8837 | High Similarity | NPC109675 |
0.8837 | High Similarity | NPC173350 |
0.8837 | High Similarity | NPC290605 |
0.8828 | High Similarity | NPC144418 |
0.8788 | High Similarity | NPC469453 |
0.8788 | High Similarity | NPC472519 |
0.8769 | High Similarity | NPC27671 |
0.876 | High Similarity | NPC13007 |
0.876 | High Similarity | NPC257188 |
0.8759 | High Similarity | NPC14697 |
0.875 | High Similarity | NPC163200 |
0.874 | High Similarity | NPC281356 |
0.874 | High Similarity | NPC298796 |
0.8723 | High Similarity | NPC76657 |
0.8705 | High Similarity | NPC279851 |
0.8705 | High Similarity | NPC300611 |
0.8705 | High Similarity | NPC215512 |
0.8705 | High Similarity | NPC472520 |
0.8705 | High Similarity | NPC476442 |
0.869 | High Similarity | NPC470264 |
0.8682 | High Similarity | NPC52247 |
0.8682 | High Similarity | NPC187868 |
0.8676 | High Similarity | NPC131950 |
0.8676 | High Similarity | NPC92830 |
0.8667 | High Similarity | NPC123954 |
0.8662 | High Similarity | NPC205361 |
0.8661 | High Similarity | NPC152306 |
0.8661 | High Similarity | NPC265547 |
0.8661 | High Similarity | NPC96705 |
0.8657 | High Similarity | NPC32463 |
0.8626 | High Similarity | NPC291899 |
0.8623 | High Similarity | NPC131198 |
0.8605 | High Similarity | NPC302107 |
0.8605 | High Similarity | NPC235190 |
0.8605 | High Similarity | NPC180006 |
0.8603 | High Similarity | NPC1220 |
0.8603 | High Similarity | NPC291551 |
0.8603 | High Similarity | NPC205797 |
0.8603 | High Similarity | NPC469965 |
0.8603 | High Similarity | NPC141822 |
0.8603 | High Similarity | NPC241165 |
0.8603 | High Similarity | NPC2363 |
0.8603 | High Similarity | NPC142563 |
0.8592 | High Similarity | NPC476450 |
0.8582 | High Similarity | NPC229916 |
0.8582 | High Similarity | NPC119640 |
0.8582 | High Similarity | NPC236419 |
0.8582 | High Similarity | NPC183646 |
0.8571 | High Similarity | NPC138149 |
0.8571 | High Similarity | NPC473993 |
0.8561 | High Similarity | NPC13067 |
0.8561 | High Similarity | NPC270256 |
0.8561 | High Similarity | NPC278600 |
0.8561 | High Similarity | NPC221046 |
0.8561 | High Similarity | NPC168259 |
0.8561 | High Similarity | NPC202594 |
0.8561 | High Similarity | NPC144512 |
0.8561 | High Similarity | NPC37428 |
0.8561 | High Similarity | NPC35501 |
0.8561 | High Similarity | NPC232692 |
0.8561 | High Similarity | NPC47040 |
0.8561 | High Similarity | NPC137262 |
0.8552 | High Similarity | NPC103116 |
0.8551 | High Similarity | NPC262585 |
0.8551 | High Similarity | NPC20829 |
0.8551 | High Similarity | NPC167517 |
0.8551 | High Similarity | NPC18189 |
0.8551 | High Similarity | NPC103409 |
0.855 | High Similarity | NPC50720 |
0.855 | High Similarity | NPC315807 |
0.854 | High Similarity | NPC117048 |
0.854 | High Similarity | NPC124085 |
0.8529 | High Similarity | NPC2190 |
0.8529 | High Similarity | NPC19157 |
0.8529 | High Similarity | NPC469956 |
0.8529 | High Similarity | NPC175159 |
0.8527 | High Similarity | NPC247553 |
0.8521 | High Similarity | NPC476457 |
0.8519 | High Similarity | NPC19242 |
0.8511 | High Similarity | NPC93640 |
0.8511 | High Similarity | NPC20631 |
0.8507 | High Similarity | NPC139595 |
0.8507 | High Similarity | NPC293642 |
0.8507 | High Similarity | NPC60704 |
0.8504 | High Similarity | NPC128633 |
0.8489 | Intermediate Similarity | NPC148835 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC98179 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 |
---|---|---|---|
0.8682 | High Similarity | NPD422 | Phase 1 |
0.8603 | High Similarity | NPD5124 | Phase 1 |
0.8603 | High Similarity | NPD5123 | Clinical (unspecified phase) |
0.844 | Intermediate Similarity | NPD1652 | Phase 2 |
0.8079 | Intermediate Similarity | NPD7096 | Clinical (unspecified phase) |
0.7987 | Intermediate Similarity | NPD1653 | Approved |
0.7986 | Intermediate Similarity | NPD6859 | Clinical (unspecified phase) |
0.7971 | Intermediate Similarity | NPD1008 | Clinical (unspecified phase) |
0.7955 | Intermediate Similarity | NPD1548 | Phase 1 |
0.7931 | Intermediate Similarity | NPD1243 | Approved |
0.7922 | Intermediate Similarity | NPD7075 | Discontinued |
0.7919 | Intermediate Similarity | NPD920 | Approved |
0.7895 | Intermediate Similarity | NPD6801 | Discontinued |
0.7891 | Intermediate Similarity | NPD643 | Clinical (unspecified phase) |
0.7872 | Intermediate Similarity | NPD1612 | Clinical (unspecified phase) |
0.7872 | Intermediate Similarity | NPD1613 | Approved |
0.7862 | Intermediate Similarity | NPD2424 | Discontinued |
0.7857 | Intermediate Similarity | NPD4907 | Clinical (unspecified phase) |
0.7857 | Intermediate Similarity | NPD1296 | Phase 2 |
0.7852 | Intermediate Similarity | NPD1610 | Phase 2 |
0.7838 | Intermediate Similarity | NPD6799 | Approved |
0.7785 | Intermediate Similarity | NPD642 | Clinical (unspecified phase) |
0.7756 | Intermediate Similarity | NPD919 | Approved |
0.7755 | Intermediate Similarity | NPD3750 | Approved |
0.7746 | Intermediate Similarity | NPD4060 | Phase 1 |
0.7714 | Intermediate Similarity | NPD4908 | Phase 1 |
0.7714 | Intermediate Similarity | NPD1529 | Clinical (unspecified phase) |
0.7692 | Intermediate Similarity | NPD6355 | Discontinued |
0.7667 | Intermediate Similarity | NPD5401 | Approved |
0.7656 | Intermediate Similarity | NPD1358 | Approved |
0.7656 | Intermediate Similarity | NPD290 | Approved |
0.7655 | Intermediate Similarity | NPD3748 | Approved |
0.7647 | Intermediate Similarity | NPD6599 | Discontinued |
0.7647 | Intermediate Similarity | NPD4380 | Phase 2 |
0.7643 | Intermediate Similarity | NPD1530 | Clinical (unspecified phase) |
0.7638 | Intermediate Similarity | NPD9697 | Approved |
0.7635 | Intermediate Similarity | NPD4628 | Phase 3 |
0.7635 | Intermediate Similarity | NPD6398 | Clinical (unspecified phase) |
0.7619 | Intermediate Similarity | NPD1549 | Phase 2 |
0.7613 | Intermediate Similarity | NPD7819 | Suspended |
0.7606 | Intermediate Similarity | NPD6798 | Discontinued |
0.7603 | Intermediate Similarity | NPD2796 | Approved |
0.7603 | Intermediate Similarity | NPD1551 | Phase 2 |
0.7597 | Intermediate Similarity | NPD7411 | Suspended |
0.7591 | Intermediate Similarity | NPD1091 | Approved |
0.7568 | Intermediate Similarity | NPD7421 | Clinical (unspecified phase) |
0.7566 | Intermediate Similarity | NPD5403 | Approved |
0.7554 | Intermediate Similarity | NPD3225 | Approved |
0.7554 | Intermediate Similarity | NPD8651 | Approved |
0.7551 | Intermediate Similarity | NPD5763 | Approved |
0.7551 | Intermediate Similarity | NPD5762 | Approved |
0.7551 | Intermediate Similarity | NPD1552 | Clinical (unspecified phase) |
0.7551 | Intermediate Similarity | NPD1550 | Clinical (unspecified phase) |
0.755 | Intermediate Similarity | NPD4378 | Clinical (unspecified phase) |
0.7535 | Intermediate Similarity | NPD3027 | Phase 3 |
0.7534 | Intermediate Similarity | NPD1510 | Phase 2 |
0.7534 | Intermediate Similarity | NPD7033 | Discontinued |
0.7516 | Intermediate Similarity | NPD7768 | Phase 2 |
0.7516 | Intermediate Similarity | NPD4868 | Clinical (unspecified phase) |
0.75 | Intermediate Similarity | NPD2797 | Approved |
0.75 | Intermediate Similarity | NPD5691 | Approved |
0.75 | Intermediate Similarity | NPD970 | Clinical (unspecified phase) |
0.75 | Intermediate Similarity | NPD2393 | Clinical (unspecified phase) |
0.7485 | Intermediate Similarity | NPD5844 | Phase 1 |
0.7468 | Intermediate Similarity | NPD4381 | Clinical (unspecified phase) |
0.7462 | Intermediate Similarity | NPD2684 | Approved |
0.7455 | Intermediate Similarity | NPD6559 | Discontinued |
0.7452 | Intermediate Similarity | NPD3817 | Phase 2 |
0.7448 | Intermediate Similarity | NPD4340 | Discontinued |
0.7445 | Intermediate Similarity | NPD4626 | Approved |
0.7436 | Intermediate Similarity | NPD1934 | Approved |
0.7434 | Intermediate Similarity | NPD7410 | Clinical (unspecified phase) |
0.7432 | Intermediate Similarity | NPD6003 | Clinical (unspecified phase) |
0.7432 | Intermediate Similarity | NPD6002 | Phase 3 |
0.7432 | Intermediate Similarity | NPD6004 | Phase 3 |
0.7432 | Intermediate Similarity | NPD6006 | Clinical (unspecified phase) |
0.7432 | Intermediate Similarity | NPD6005 | Phase 3 |
0.7417 | Intermediate Similarity | NPD5058 | Phase 3 |
0.7415 | Intermediate Similarity | NPD4308 | Phase 3 |
0.7413 | Intermediate Similarity | NPD4625 | Phase 3 |
0.741 | Intermediate Similarity | NPD9717 | Approved |
0.7405 | Intermediate Similarity | NPD3882 | Suspended |
0.74 | Intermediate Similarity | NPD1878 | Clinical (unspecified phase) |
0.7391 | Intermediate Similarity | NPD3496 | Discontinued |
0.7386 | Intermediate Similarity | NPD7314 | Clinical (unspecified phase) |
0.7379 | Intermediate Similarity | NPD1240 | Approved |
0.7372 | Intermediate Similarity | NPD7615 | Clinical (unspecified phase) |
0.7368 | Intermediate Similarity | NPD7843 | Approved |
0.7368 | Intermediate Similarity | NPD5535 | Approved |
0.7361 | Intermediate Similarity | NPD6410 | Clinical (unspecified phase) |
0.7361 | Intermediate Similarity | NPD3268 | Approved |
0.7358 | Intermediate Similarity | NPD3749 | Approved |
0.7357 | Intermediate Similarity | NPD4749 | Approved |
0.7347 | Intermediate Similarity | NPD7097 | Phase 1 |
0.7342 | Intermediate Similarity | NPD5402 | Approved |
0.7333 | Intermediate Similarity | NPD7157 | Approved |
0.7329 | Intermediate Similarity | NPD7199 | Phase 2 |
0.732 | Intermediate Similarity | NPD2533 | Approved |
0.732 | Intermediate Similarity | NPD2534 | Approved |
0.732 | Intermediate Similarity | NPD2532 | Approved |
0.7319 | Intermediate Similarity | NPD1778 | Approved |
0.7317 | Intermediate Similarity | NPD3818 | Discontinued |
0.731 | Intermediate Similarity | NPD6233 | Phase 2 |
0.7308 | Intermediate Similarity | NPD3134 | Approved |
0.7297 | Intermediate Similarity | NPD2799 | Discontinued |
0.7297 | Intermediate Similarity | NPD5588 | Approved |
0.7292 | Intermediate Similarity | NPD7095 | Approved |
0.7279 | Intermediate Similarity | NPD1607 | Approved |
0.7273 | Intermediate Similarity | NPD7804 | Clinical (unspecified phase) |
0.7267 | Intermediate Similarity | NPD5494 | Approved |
0.726 | Intermediate Similarity | NPD4307 | Phase 2 |
0.726 | Intermediate Similarity | NPD4140 | Approved |
0.7255 | Intermediate Similarity | NPD1511 | Approved |
0.7254 | Intermediate Similarity | NPD1203 | Approved |
0.7254 | Intermediate Similarity | NPD3267 | Approved |
0.7254 | Intermediate Similarity | NPD987 | Approved |
0.7254 | Intermediate Similarity | NPD3266 | Approved |
0.7248 | Intermediate Similarity | NPD2935 | Discontinued |
0.7241 | Intermediate Similarity | NPD1699 | Clinical (unspecified phase) |
0.7241 | Intermediate Similarity | NPD2313 | Discontinued |
0.7239 | Intermediate Similarity | NPD7184 | Clinical (unspecified phase) |
0.7233 | Intermediate Similarity | NPD8443 | Clinical (unspecified phase) |
0.7233 | Intermediate Similarity | NPD2415 | Discontinued |
0.723 | Intermediate Similarity | NPD4537 | Clinical (unspecified phase) |
0.723 | Intermediate Similarity | NPD4536 | Approved |
0.723 | Intermediate Similarity | NPD4538 | Approved |
0.7222 | Intermediate Similarity | NPD1247 | Approved |
0.7222 | Intermediate Similarity | NPD6832 | Phase 2 |
0.7219 | Intermediate Similarity | NPD5698 | Clinical (unspecified phase) |
0.7219 | Intermediate Similarity | NPD2800 | Approved |
0.7215 | Intermediate Similarity | NPD37 | Approved |
0.7214 | Intermediate Similarity | NPD1611 | Approved |
0.7211 | Intermediate Similarity | NPD447 | Suspended |
0.7211 | Intermediate Similarity | NPD230 | Phase 1 |
0.7205 | Intermediate Similarity | NPD6234 | Discontinued |
0.7202 | Intermediate Similarity | NPD7549 | Discontinued |
0.72 | Intermediate Similarity | NPD2343 | Clinical (unspecified phase) |
0.7195 | Intermediate Similarity | NPD7852 | Clinical (unspecified phase) |
0.7192 | Intermediate Similarity | NPD4062 | Phase 3 |
0.719 | Intermediate Similarity | NPD6667 | Approved |
0.719 | Intermediate Similarity | NPD6666 | Approved |
0.7188 | Intermediate Similarity | NPD4966 | Approved |
0.7188 | Intermediate Similarity | NPD4967 | Phase 2 |
0.7188 | Intermediate Similarity | NPD4965 | Approved |
0.7185 | Intermediate Similarity | NPD1241 | Discontinued |
0.7178 | Intermediate Similarity | NPD7229 | Phase 3 |
0.717 | Intermediate Similarity | NPD1465 | Phase 2 |
0.717 | Intermediate Similarity | NPD8455 | Phase 2 |
0.717 | Intermediate Similarity | NPD2801 | Approved |
0.7163 | Intermediate Similarity | NPD1608 | Approved |
0.7161 | Intermediate Similarity | NPD1512 | Approved |
0.7153 | Intermediate Similarity | NPD2861 | Phase 2 |
0.7134 | Intermediate Similarity | NPD8158 | Clinical (unspecified phase) |
0.7123 | Intermediate Similarity | NPD1048 | Approved |
0.7115 | Intermediate Similarity | NPD6980 | Clinical (unspecified phase) |
0.7083 | Intermediate Similarity | NPD1019 | Discontinued |
0.7083 | Intermediate Similarity | NPD6917 | Clinical (unspecified phase) |
0.7067 | Intermediate Similarity | NPD5960 | Phase 3 |
0.7051 | Intermediate Similarity | NPD5049 | Phase 3 |
0.7051 | Intermediate Similarity | NPD1940 | Clinical (unspecified phase) |
0.705 | Intermediate Similarity | NPD1894 | Discontinued |
0.705 | Intermediate Similarity | NPD9545 | Approved |
0.7047 | Intermediate Similarity | NPD6653 | Approved |
0.7034 | Intermediate Similarity | NPD3018 | Phase 2 |
0.7032 | Intermediate Similarity | NPD7212 | Phase 2 |
0.7032 | Intermediate Similarity | NPD6143 | Clinical (unspecified phase) |
0.7032 | Intermediate Similarity | NPD7213 | Phase 3 |
0.702 | Intermediate Similarity | NPD4477 | Approved |
0.702 | Intermediate Similarity | NPD6032 | Approved |
0.702 | Intermediate Similarity | NPD4476 | Approved |
0.7019 | Intermediate Similarity | NPD4288 | Approved |
0.7012 | Intermediate Similarity | NPD8127 | Discontinued |
0.7007 | Intermediate Similarity | NPD3764 | Approved |
0.7007 | Intermediate Similarity | NPD411 | Approved |
0.7 | Intermediate Similarity | NPD940 | Approved |
0.7 | Intermediate Similarity | NPD4433 | Discontinued |
0.7 | Intermediate Similarity | NPD846 | Approved |
0.6988 | Remote Similarity | NPD6168 | Clinical (unspecified phase) |
0.6988 | Remote Similarity | NPD6166 | Phase 2 |
0.6988 | Remote Similarity | NPD6167 | Clinical (unspecified phase) |
0.6987 | Remote Similarity | NPD7004 | Clinical (unspecified phase) |
0.6987 | Remote Similarity | NPD7447 | Phase 1 |
0.6982 | Remote Similarity | NPD5953 | Discontinued |
0.6982 | Remote Similarity | NPD7993 | Clinical (unspecified phase) |
0.698 | Remote Similarity | NPD1899 | Clinical (unspecified phase) |
0.6974 | Remote Similarity | NPD7266 | Discontinued |
0.697 | Remote Similarity | NPD6232 | Discontinued |
0.6966 | Remote Similarity | NPD3691 | Phase 2 |
0.6966 | Remote Similarity | NPD3690 | Phase 2 |
0.6964 | Remote Similarity | NPD7054 | Approved |
0.6957 | Remote Similarity | NPD6671 | Approved |
0.695 | Remote Similarity | NPD17 | Approved |
0.6948 | Remote Similarity | NPD4110 | Phase 3 |
0.6948 | Remote Similarity | NPD4109 | Clinical (unspecified phase) |
0.6948 | Remote Similarity | NPD7466 | Approved |
0.6948 | Remote Similarity | NPD7982 | Clinical (unspecified phase) |
0.6944 | Remote Similarity | NPD6696 | Suspended |
0.6944 | Remote Similarity | NPD1283 | Approved |
0.6943 | Remote Similarity | NPD6273 | Approved |
0.6937 | Remote Similarity | NPD6072 | Discontinued |
PubChem CID   | 334704 |
ChEMBL   | CHEMBL442813 |
ZINC   |
Molecular Weight:   | 246.09 |
ALogP:   | 0.2617 |
MLogP:   | 2.56 |
XLogP:   | 2.093 |
# Rotatable Bonds:   | 4 |
Polar Surface Area:   | 55.76 |
# H-Bond Aceptor:   | 2 |
# H-Bond Donor:   | 1 |
# Rings:   | 3 |
# Heavy Atoms:   | 18 |