Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO665.6 | Streptomyces diastatochromogenes var. sakaii fn 1636 | Subspecies | Streptomycetaceae | Bacteria | StreptomeDB* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT367 | Cell Line | MDA-N | Homo sapiens | GI50 | 59156.16 | nM | PubChem BioAssay data set | |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT90 | Cell Line | DU-145 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT376 | Cell Line | A498 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | 28906.8 | nM | PubChem BioAssay data set | |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | GI50 | 51522.86 | nM | PubChem BioAssay data set | |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | 62230.03 | nM | PubChem BioAssay data set | |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | 64416.93 | nM | PubChem BioAssay data set | |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | 67142.89 | nM | PubChem BioAssay data set | |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | 10000 | nM | PubChem BioAssay data set | |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | 68233.87 | nM | PubChem BioAssay data set | |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | 80167.81 | nM | PubChem BioAssay data set | |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | 60255.96 | nM | PubChem BioAssay data set | |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | GI50 | 9204.5 | nM | PubChem BioAssay data set | |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | 91833.26 | nM | PubChem BioAssay data set | |
NPT457 | Cell Line | BT-549 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | 53703.18 | nM | PubChem BioAssay data set | |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | 74473.2 | nM | PubChem BioAssay data set | |
NPT392 | Cell Line | SNB-75 | Homo sapiens | GI50 | 99540.54 | nM | PubChem BioAssay data set | |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | 57942.87 | nM | PubChem BioAssay data set | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | 55080.77 | nM | PubChem BioAssay data set | |
NPT394 | Cell Line | EKVX | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT306 | Cell Line | PC-3 | Homo sapiens | GI50 | 45708.82 | nM | PubChem BioAssay data set | |
NPT83 | Cell Line | MCF7 | Homo sapiens | GI50 | 47424.2 | nM | PubChem BioAssay data set | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | 98174.79 | nM | PubChem BioAssay data set | |
NPT396 | Cell Line | T47D | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | 59292.53 | nM | PubChem BioAssay data set | |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | GI50 | 71779.43 | nM | PubChem BioAssay data set | |
NPT399 | Cell Line | SF-295 | Homo sapiens | GI50 | 60255.96 | nM | PubChem BioAssay data set | |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | 67764.15 | nM | PubChem BioAssay data set | |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT402 | Cell Line | Hs-578T | Homo sapiens | GI50 | 50582.47 | nM | PubChem BioAssay data set | |
NPT403 | Cell Line | UACC-257 | Homo sapiens | GI50 | 100000 | nM | PubChem BioAssay data set | |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | 62805.84 | nM | PubChem BioAssay data set | |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | 61944.11 | nM | PubChem BioAssay data set | |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | 80537.84 | nM | PubChem BioAssay data set | |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | 70469.31 | nM | PubChem BioAssay data set | |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | 38018.94 | 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 NPC314221 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 | NPC60424 |
0.75 | Intermediate Similarity | NPC133700 |
0.7097 | Intermediate Similarity | NPC324825 |
0.7097 | Intermediate Similarity | NPC112890 |
0.7097 | Intermediate Similarity | NPC316231 |
0.6962 | Remote Similarity | NPC157173 |
0.6901 | Remote Similarity | NPC50047 |
0.6667 | Remote Similarity | NPC207292 |
0.6667 | Remote Similarity | NPC183845 |
0.6667 | Remote Similarity | NPC279661 |
0.662 | Remote Similarity | NPC47333 |
0.6618 | Remote Similarity | NPC278209 |
0.6593 | Remote Similarity | NPC122493 |
0.6593 | Remote Similarity | NPC10781 |
0.6593 | Remote Similarity | NPC293628 |
0.6593 | Remote Similarity | NPC324569 |
0.6562 | Remote Similarity | NPC5413 |
0.6562 | Remote Similarity | NPC149821 |
0.6557 | Remote Similarity | NPC323974 |
0.6556 | Remote Similarity | NPC40663 |
0.6522 | Remote Similarity | NPC176164 |
0.6522 | Remote Similarity | NPC189301 |
0.6452 | Remote Similarity | NPC118459 |
0.6452 | Remote Similarity | NPC327698 |
0.6429 | Remote Similarity | NPC276928 |
0.6429 | Remote Similarity | NPC254541 |
0.6429 | Remote Similarity | NPC268927 |
0.6429 | Remote Similarity | NPC320598 |
0.6429 | Remote Similarity | NPC64250 |
0.6406 | Remote Similarity | NPC93081 |
0.6406 | Remote Similarity | NPC140872 |
0.6395 | Remote Similarity | NPC202056 |
0.6364 | Remote Similarity | NPC28205 |
0.6308 | Remote Similarity | NPC43204 |
0.6308 | Remote Similarity | NPC84636 |
0.6308 | Remote Similarity | NPC245027 |
0.6308 | Remote Similarity | NPC62045 |
0.6308 | Remote Similarity | NPC226027 |
0.6308 | Remote Similarity | NPC162620 |
0.6308 | Remote Similarity | NPC174246 |
0.6279 | Remote Similarity | NPC90476 |
0.6279 | Remote Similarity | NPC69374 |
0.6269 | Remote Similarity | NPC281245 |
0.6269 | Remote Similarity | NPC92114 |
0.6267 | Remote Similarity | NPC113224 |
0.6212 | Remote Similarity | NPC50457 |
0.6207 | Remote Similarity | NPC258824 |
0.6197 | Remote Similarity | NPC325734 |
0.6176 | Remote Similarity | NPC321062 |
0.6176 | Remote Similarity | NPC70387 |
0.6176 | Remote Similarity | NPC139029 |
0.6176 | Remote Similarity | NPC1813 |
0.6176 | Remote Similarity | NPC294548 |
0.6176 | Remote Similarity | NPC36061 |
0.6154 | Remote Similarity | NPC91495 |
0.6154 | Remote Similarity | NPC315199 |
0.6122 | Remote Similarity | NPC67043 |
0.6119 | Remote Similarity | NPC155512 |
0.6119 | Remote Similarity | NPC284212 |
0.6119 | Remote Similarity | NPC48162 |
0.6111 | Remote Similarity | NPC236322 |
0.6111 | Remote Similarity | NPC319021 |
0.6111 | Remote Similarity | NPC68974 |
0.6094 | Remote Similarity | NPC117572 |
0.6087 | Remote Similarity | NPC87564 |
0.6087 | Remote Similarity | NPC6095 |
0.6087 | Remote Similarity | NPC154245 |
0.6087 | Remote Similarity | NPC32467 |
0.6087 | Remote Similarity | NPC85813 |
0.6087 | Remote Similarity | NPC290563 |
0.6087 | Remote Similarity | NPC424 |
0.6087 | Remote Similarity | NPC25417 |
0.6087 | Remote Similarity | NPC88966 |
0.6087 | Remote Similarity | NPC281972 |
0.6087 | Remote Similarity | NPC261831 |
0.6082 | Remote Similarity | NPC164859 |
0.6081 | Remote Similarity | NPC316674 |
0.6056 | Remote Similarity | NPC319279 |
0.6056 | Remote Similarity | NPC168308 |
0.6056 | Remote Similarity | NPC302569 |
0.6 | Remote Similarity | NPC274290 |
0.6 | Remote Similarity | NPC473863 |
0.6 | Remote Similarity | NPC54766 |
0.6 | Remote Similarity | NPC304455 |
0.5974 | Remote Similarity | NPC98329 |
0.5974 | Remote Similarity | NPC7392 |
0.597 | Remote Similarity | NPC273330 |
0.597 | Remote Similarity | NPC137958 |
0.597 | Remote Similarity | NPC59051 |
0.5941 | Remote Similarity | NPC298484 |
0.5918 | Remote Similarity | NPC469895 |
0.5915 | Remote Similarity | NPC18951 |
0.5915 | Remote Similarity | NPC477201 |
0.5915 | Remote Similarity | NPC179764 |
0.5915 | Remote Similarity | NPC187777 |
0.5909 | Remote Similarity | NPC180534 |
0.59 | Remote Similarity | NPC327481 |
0.5882 | Remote Similarity | NPC178586 |
0.5875 | Remote Similarity | NPC320669 |
0.5875 | Remote Similarity | NPC318814 |
0.5873 | Remote Similarity | NPC276294 |
0.5844 | Remote Similarity | NPC322035 |
0.5844 | Remote Similarity | NPC188231 |
0.5844 | Remote Similarity | NPC222327 |
0.5844 | Remote Similarity | NPC166791 |
0.5844 | Remote Similarity | NPC100719 |
0.5833 | Remote Similarity | NPC225929 |
0.5825 | Remote Similarity | NPC319579 |
0.5806 | Remote Similarity | NPC326992 |
0.5806 | Remote Similarity | NPC168375 |
0.5806 | Remote Similarity | NPC121517 |
0.5797 | Remote Similarity | NPC129458 |
0.5797 | Remote Similarity | NPC190184 |
0.5797 | Remote Similarity | NPC216407 |
0.5797 | Remote Similarity | NPC197087 |
0.5789 | Remote Similarity | NPC278881 |
0.5789 | Remote Similarity | NPC234767 |
0.5781 | Remote Similarity | NPC132307 |
0.5781 | Remote Similarity | NPC126925 |
0.5781 | Remote Similarity | NPC325097 |
0.5773 | Remote Similarity | NPC12730 |
0.5769 | Remote Similarity | NPC107224 |
0.5769 | Remote Similarity | NPC329011 |
0.5765 | Remote Similarity | NPC314762 |
0.5758 | Remote Similarity | NPC42304 |
0.5753 | Remote Similarity | NPC327748 |
0.5753 | Remote Similarity | NPC316826 |
0.5753 | Remote Similarity | NPC321468 |
0.5753 | Remote Similarity | NPC267817 |
0.5753 | Remote Similarity | NPC34416 |
0.5753 | Remote Similarity | NPC317143 |
0.5735 | Remote Similarity | NPC224227 |
0.5733 | Remote Similarity | NPC125312 |
0.5733 | Remote Similarity | NPC174560 |
0.5733 | Remote Similarity | NPC273614 |
0.5714 | Remote Similarity | NPC10081 |
0.5714 | Remote Similarity | NPC145235 |
0.5714 | Remote Similarity | NPC474584 |
0.5714 | Remote Similarity | NPC225066 |
0.5696 | Remote Similarity | NPC15864 |
0.5694 | Remote Similarity | NPC318260 |
0.5694 | Remote Similarity | NPC317147 |
0.5694 | Remote Similarity | NPC325977 |
0.5692 | Remote Similarity | NPC329263 |
0.5679 | Remote Similarity | NPC315897 |
0.5676 | Remote Similarity | NPC274927 |
0.5676 | Remote Similarity | NPC327170 |
0.5676 | Remote Similarity | NPC329550 |
0.5676 | Remote Similarity | NPC106851 |
0.5676 | Remote Similarity | NPC329564 |
0.567 | Remote Similarity | NPC132931 |
0.5663 | Remote Similarity | NPC212008 |
0.5663 | Remote Similarity | NPC51055 |
0.5663 | Remote Similarity | NPC3094 |
0.5663 | Remote Similarity | NPC62293 |
0.5663 | Remote Similarity | NPC140327 |
0.5658 | Remote Similarity | NPC55068 |
0.5658 | Remote Similarity | NPC477707 |
0.5657 | Remote Similarity | NPC72401 |
0.5657 | Remote Similarity | NPC325339 |
0.5652 | Remote Similarity | NPC262968 |
0.5634 | Remote Similarity | NPC322461 |
0.5634 | Remote Similarity | NPC2801 |
0.5634 | Remote Similarity | NPC87394 |
0.5634 | Remote Similarity | NPC137538 |
0.5625 | Remote Similarity | NPC291186 |
0.5625 | Remote Similarity | NPC471257 |
0.5625 | Remote Similarity | NPC167986 |
0.5625 | Remote Similarity | NPC3604 |
0.5616 | Remote Similarity | NPC190385 |
0.5616 | Remote Similarity | NPC11433 |
0.5616 | Remote Similarity | NPC245346 |
0.5616 | Remote Similarity | NPC302003 |
0.5612 | Remote Similarity | NPC239768 |
0.5612 | Remote Similarity | NPC128698 |
0.561 | Remote Similarity | NPC26932 |
0.5604 | Remote Similarity | NPC472614 |
0.56 | Remote Similarity | NPC251042 |
0.56 | Remote Similarity | NPC243532 |
0.56 | Remote Similarity | NPC302188 |
0.56 | Remote Similarity | NPC235242 |
0.56 | Remote Similarity | NPC174447 |
0.56 | Remote Similarity | NPC122521 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC314221 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 |
---|---|---|---|
0.7344 | Intermediate Similarity | NPD8971 | Approved |
0.7286 | Intermediate Similarity | NPD9201 | Clinical (unspecified phase) |
0.7097 | Intermediate Similarity | NPD9016 | Clinical (unspecified phase) |
0.7097 | Intermediate Similarity | NPD9044 | Approved |
0.6835 | Remote Similarity | NPD3732 | Approved |
0.6593 | Remote Similarity | NPD9566 | Approved |
0.6562 | Remote Similarity | NPD3173 | Approved |
0.6557 | Remote Similarity | NPD9019 | Approved |
0.6406 | Remote Similarity | NPD8809 | Approved |
0.6406 | Remote Similarity | NPD8808 | Approved |
0.6386 | Remote Similarity | NPD857 | Phase 3 |
0.6308 | Remote Similarity | NPD9017 | Approved |
0.6308 | Remote Similarity | NPD9018 | Approved |
0.6203 | Remote Similarity | NPD9109 | Discontinued |
0.6176 | Remote Similarity | NPD3172 | Approved |
0.6094 | Remote Similarity | NPD4222 | Approved |
0.6094 | Remote Similarity | NPD3174 | Discontinued |
0.6087 | Remote Similarity | NPD3194 | Approved |
0.6087 | Remote Similarity | NPD3196 | Approved |
0.6087 | Remote Similarity | NPD3195 | Phase 2 |
0.6087 | Remote Similarity | NPD4266 | Approved |
0.6056 | Remote Similarity | NPD9439 | Approved |
0.6056 | Remote Similarity | NPD9438 | Approved |
0.6053 | Remote Similarity | NPD9421 | Phase 1 |
0.6 | Remote Similarity | NPD9454 | Approved |
0.5974 | Remote Similarity | NPD9137 | Approved |
0.597 | Remote Similarity | NPD8872 | Phase 3 |
0.597 | Remote Similarity | NPD8871 | Approved |
0.5946 | Remote Similarity | NPD9676 | Phase 3 |
0.5918 | Remote Similarity | NPD2258 | Approved |
0.5918 | Remote Similarity | NPD2259 | Approved |
0.5909 | Remote Similarity | NPD622 | Approved |
0.587 | Remote Similarity | NPD1749 | Approved |
0.5846 | Remote Similarity | NPD39 | Approved |
0.5833 | Remote Similarity | NPD253 | Approved |
0.5797 | Remote Similarity | NPD8785 | Approved |
0.5797 | Remote Similarity | NPD8851 | Phase 1 |
0.5781 | Remote Similarity | NPD8798 | Approved |
0.5775 | Remote Similarity | NPD8981 | Clinical (unspecified phase) |
0.5775 | Remote Similarity | NPD8980 | Approved |
0.5775 | Remote Similarity | NPD8979 | Approved |
0.5769 | Remote Similarity | NPD9451 | Clinical (unspecified phase) |
0.5732 | Remote Similarity | NPD632 | Discontinued |
0.5679 | Remote Similarity | NPD1825 | Clinical (unspecified phase) |
0.5658 | Remote Similarity | NPD3210 | Clinical (unspecified phase) |
0.5652 | Remote Similarity | NPD29 | Approved |
0.5652 | Remote Similarity | NPD28 | Approved |
0.5625 | Remote Similarity | NPD8805 | Approved |
0.5625 | Remote Similarity | NPD8804 | Approved |
0.5616 | Remote Similarity | NPD9023 | Clinical (unspecified phase) |
0.5616 | Remote Similarity | NPD8865 | Approved |
0.5616 | Remote Similarity | NPD9433 | Approved |
0.561 | Remote Similarity | NPD9217 | Clinical (unspecified phase) |
0.5607 | Remote Similarity | NPD747 | Discontinued |
0.56 | Remote Similarity | NPD9656 | Approved |
PubChem CID   | 204298 |
ChEMBL   | CHEMBL1965663 |
ZINC   |
Molecular Weight:   | 167.09 |
ALogP:   | 0.0392 |
MLogP:   | 2.12 |
XLogP:   | -1.227 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 63.32 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 2 |
# Rings:   | 1 |
# Heavy Atoms:   | 12 |