Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Activity | = | 550 | Zone units | 24168147 | |
NPT2 | Others | Unspecified | TGI | = | 128.82 | nM | 24168147 | |
NPT2 | Others | Unspecified | LC50 | = | 16595.87 | nM | 24175613 | |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | Activity | = | 550 | Zone units | 12350171 |
NPT730 | Cell Line | MC-38 | Mus musculus | Activity | = | 550 | Zone units | 12350171 |
NPT2 | Others | Unspecified | Activity | = | 550 | Zone units | 12350171 | |
NPT2 | Others | Unspecified | Activity | = | 550 | Zone units | PubChem BioAssay data set | |
NPT137 | Cell Line | L1210 | Mus musculus | Activity | = | 550 | Zone units | PubChem BioAssay data set |
NPT2 | Others | Unspecified | GI50 | = | 5.754 | nM | 15217270 |
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 NPC92829 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 |
---|---|---|
0.9712 | High Similarity | NPC122404 |
0.9619 | High Similarity | NPC24462 |
0.9417 | High Similarity | NPC168733 |
0.9314 | High Similarity | NPC259476 |
0.8545 | High Similarity | NPC7797 |
0.8246 | Intermediate Similarity | NPC216335 |
0.7928 | Intermediate Similarity | NPC42590 |
0.6833 | Remote Similarity | NPC328052 |
0.6723 | Remote Similarity | NPC475800 |
0.6667 | Remote Similarity | NPC106479 |
0.6612 | Remote Similarity | NPC474725 |
0.6557 | Remote Similarity | NPC46764 |
0.6535 | Remote Similarity | NPC323532 |
0.6518 | Remote Similarity | NPC100313 |
0.6504 | Remote Similarity | NPC12270 |
0.6471 | Remote Similarity | NPC474563 |
0.6429 | Remote Similarity | NPC194642 |
0.6404 | Remote Similarity | NPC199543 |
0.6396 | Remote Similarity | NPC259009 |
0.6393 | Remote Similarity | NPC140251 |
0.6393 | Remote Similarity | NPC307903 |
0.6372 | Remote Similarity | NPC470378 |
0.6372 | Remote Similarity | NPC149761 |
0.6372 | Remote Similarity | NPC261994 |
0.6372 | Remote Similarity | NPC80401 |
0.6364 | Remote Similarity | NPC471034 |
0.6364 | Remote Similarity | NPC190704 |
0.6348 | Remote Similarity | NPC302008 |
0.6348 | Remote Similarity | NPC191094 |
0.6348 | Remote Similarity | NPC280804 |
0.6316 | Remote Similarity | NPC314500 |
0.6316 | Remote Similarity | NPC299185 |
0.6316 | Remote Similarity | NPC476168 |
0.6293 | Remote Similarity | NPC138245 |
0.6293 | Remote Similarity | NPC84018 |
0.6293 | Remote Similarity | NPC231060 |
0.629 | Remote Similarity | NPC476290 |
0.6283 | Remote Similarity | NPC77001 |
0.6283 | Remote Similarity | NPC253618 |
0.6271 | Remote Similarity | NPC234542 |
0.6269 | Remote Similarity | NPC477352 |
0.6261 | Remote Similarity | NPC147272 |
0.6261 | Remote Similarity | NPC181594 |
0.6261 | Remote Similarity | NPC144739 |
0.626 | Remote Similarity | NPC128210 |
0.625 | Remote Similarity | NPC472495 |
0.625 | Remote Similarity | NPC153604 |
0.6239 | Remote Similarity | NPC46881 |
0.6228 | Remote Similarity | NPC232202 |
0.6226 | Remote Similarity | NPC474433 |
0.622 | Remote Similarity | NPC470540 |
0.6218 | Remote Similarity | NPC473224 |
0.6207 | Remote Similarity | NPC101233 |
0.6207 | Remote Similarity | NPC29247 |
0.6207 | Remote Similarity | NPC473314 |
0.6207 | Remote Similarity | NPC215271 |
0.6207 | Remote Similarity | NPC111524 |
0.6207 | Remote Similarity | NPC289539 |
0.6207 | Remote Similarity | NPC292374 |
0.6207 | Remote Similarity | NPC64006 |
0.6207 | Remote Similarity | NPC104371 |
0.6207 | Remote Similarity | NPC129004 |
0.6207 | Remote Similarity | NPC91772 |
0.6207 | Remote Similarity | NPC153775 |
0.6207 | Remote Similarity | NPC261333 |
0.6207 | Remote Similarity | NPC24861 |
0.6202 | Remote Similarity | NPC476956 |
0.6198 | Remote Similarity | NPC266 |
0.6194 | Remote Similarity | NPC478207 |
0.619 | Remote Similarity | NPC476269 |
0.6186 | Remote Similarity | NPC167380 |
0.6186 | Remote Similarity | NPC111187 |
0.6186 | Remote Similarity | NPC190080 |
0.6182 | Remote Similarity | NPC471036 |
0.6182 | Remote Similarity | NPC243347 |
0.6182 | Remote Similarity | NPC291320 |
0.6174 | Remote Similarity | NPC211403 |
0.6174 | Remote Similarity | NPC198054 |
0.6174 | Remote Similarity | NPC198242 |
0.6168 | Remote Similarity | NPC253703 |
0.6168 | Remote Similarity | NPC314858 |
0.6168 | Remote Similarity | NPC200085 |
0.6168 | Remote Similarity | NPC51695 |
0.6167 | Remote Similarity | NPC39683 |
0.6161 | Remote Similarity | NPC472738 |
0.6161 | Remote Similarity | NPC472986 |
0.6161 | Remote Similarity | NPC472985 |
0.616 | Remote Similarity | NPC140409 |
0.616 | Remote Similarity | NPC11491 |
0.616 | Remote Similarity | NPC156248 |
0.6154 | Remote Similarity | NPC259042 |
0.6154 | Remote Similarity | NPC41070 |
0.6154 | Remote Similarity | NPC157686 |
0.6154 | Remote Similarity | NPC472485 |
0.6142 | Remote Similarity | NPC89018 |
0.6134 | Remote Similarity | NPC471038 |
0.6131 | Remote Similarity | NPC96425 |
0.6126 | Remote Similarity | NPC97505 |
0.6121 | Remote Similarity | NPC59170 |
0.6121 | Remote Similarity | NPC472496 |
0.6121 | Remote Similarity | NPC226513 |
0.6116 | Remote Similarity | NPC164551 |
0.6111 | Remote Similarity | NPC170294 |
0.6106 | Remote Similarity | NPC165895 |
0.6106 | Remote Similarity | NPC472497 |
0.6106 | Remote Similarity | NPC298904 |
0.6102 | Remote Similarity | NPC134072 |
0.6102 | Remote Similarity | NPC234993 |
0.6102 | Remote Similarity | NPC140242 |
0.6102 | Remote Similarity | NPC242848 |
0.6102 | Remote Similarity | NPC264979 |
0.6102 | Remote Similarity | NPC135548 |
0.6098 | Remote Similarity | NPC166607 |
0.6098 | Remote Similarity | NPC37600 |
0.6095 | Remote Similarity | NPC102313 |
0.6095 | Remote Similarity | NPC199316 |
0.6094 | Remote Similarity | NPC88867 |
0.6094 | Remote Similarity | NPC226608 |
0.6091 | Remote Similarity | NPC145143 |
0.6091 | Remote Similarity | NPC110780 |
0.6087 | Remote Similarity | NPC180849 |
0.6087 | Remote Similarity | NPC46758 |
0.6087 | Remote Similarity | NPC153853 |
0.6083 | Remote Similarity | NPC110897 |
0.6083 | Remote Similarity | NPC41971 |
0.6083 | Remote Similarity | NPC127408 |
0.6083 | Remote Similarity | NPC180733 |
0.6083 | Remote Similarity | NPC291785 |
0.6083 | Remote Similarity | NPC477655 |
0.6083 | Remote Similarity | NPC154072 |
0.6083 | Remote Similarity | NPC470388 |
0.6083 | Remote Similarity | NPC37047 |
0.608 | Remote Similarity | NPC475191 |
0.608 | Remote Similarity | NPC322912 |
0.6071 | Remote Similarity | NPC102292 |
0.6071 | Remote Similarity | NPC292553 |
0.6068 | Remote Similarity | NPC470386 |
0.6068 | Remote Similarity | NPC469982 |
0.6068 | Remote Similarity | NPC470385 |
0.6068 | Remote Similarity | NPC148000 |
0.6068 | Remote Similarity | NPC469596 |
0.6068 | Remote Similarity | NPC225474 |
0.6068 | Remote Similarity | NPC47853 |
0.6066 | Remote Similarity | NPC469985 |
0.6055 | Remote Similarity | NPC148685 |
0.6055 | Remote Similarity | NPC164999 |
0.6055 | Remote Similarity | NPC157895 |
0.6055 | Remote Similarity | NPC104120 |
0.6053 | Remote Similarity | NPC16377 |
0.605 | Remote Similarity | NPC170978 |
0.605 | Remote Similarity | NPC474395 |
0.605 | Remote Similarity | NPC253586 |
0.605 | Remote Similarity | NPC473963 |
0.6048 | Remote Similarity | NPC471246 |
0.6048 | Remote Similarity | NPC78966 |
0.6048 | Remote Similarity | NPC284732 |
0.6048 | Remote Similarity | NPC216636 |
0.6047 | Remote Similarity | NPC470466 |
0.6036 | Remote Similarity | NPC472498 |
0.6036 | Remote Similarity | NPC105173 |
0.6036 | Remote Similarity | NPC312480 |
0.6034 | Remote Similarity | NPC73457 |
0.6034 | Remote Similarity | NPC278106 |
0.6033 | Remote Similarity | NPC46848 |
0.6033 | Remote Similarity | NPC14634 |
0.6033 | Remote Similarity | NPC121218 |
0.6033 | Remote Similarity | NPC253886 |
0.6033 | Remote Similarity | NPC308824 |
0.6033 | Remote Similarity | NPC242666 |
0.6033 | Remote Similarity | NPC111292 |
0.6033 | Remote Similarity | NPC75941 |
0.6029 | Remote Similarity | NPC476957 |
0.6019 | Remote Similarity | NPC269543 |
0.6019 | Remote Similarity | NPC247783 |
0.6018 | Remote Similarity | NPC473226 |
0.6018 | Remote Similarity | NPC187545 |
0.6018 | Remote Similarity | NPC153699 |
0.6018 | Remote Similarity | NPC470955 |
0.6018 | Remote Similarity | NPC185638 |
0.6018 | Remote Similarity | NPC76164 |
0.6017 | Remote Similarity | NPC266899 |
0.6017 | Remote Similarity | NPC470232 |
0.6017 | Remote Similarity | NPC288906 |
0.6017 | Remote Similarity | NPC29112 |
0.6017 | Remote Similarity | NPC98639 |
0.6017 | Remote Similarity | NPC263135 |
0.6017 | Remote Similarity | NPC271195 |
0.6017 | Remote Similarity | NPC272617 |
0.6016 | Remote Similarity | NPC160843 |
0.6016 | Remote Similarity | NPC474281 |
0.6016 | Remote Similarity | NPC14537 |
0.6 | Remote Similarity | NPC472970 |
0.6 | Remote Similarity | NPC469319 |
0.6 | Remote Similarity | NPC476190 |
0.6 | Remote Similarity | NPC57954 |
0.6 | Remote Similarity | NPC174663 |
0.6 | Remote Similarity | NPC14151 |
0.6 | Remote Similarity | NPC78427 |
0.6 | Remote Similarity | NPC213832 |
0.6 | Remote Similarity | NPC37628 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC92829 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 |
---|---|---|---|
0.6504 | Remote Similarity | NPD1719 | Phase 1 |
0.6111 | Remote Similarity | NPD5215 | Approved |
0.6099 | Remote Similarity | NPD6334 | Approved |
0.6099 | Remote Similarity | NPD6333 | Approved |
0.6031 | Remote Similarity | NPD4522 | Approved |
0.5969 | Remote Similarity | NPD5167 | Approved |
0.595 | Remote Similarity | NPD8418 | Phase 2 |
0.5906 | Remote Similarity | NPD6420 | Discontinued |
0.5906 | Remote Similarity | NPD5169 | Approved |
0.5877 | Remote Similarity | NPD3618 | Phase 1 |
0.5873 | Remote Similarity | NPD5168 | Approved |
0.5859 | Remote Similarity | NPD5127 | Approved |
0.5859 | Remote Similarity | NPD5216 | Approved |
0.5859 | Remote Similarity | NPD5217 | Approved |
0.584 | Remote Similarity | NPD7333 | Discontinued |
0.5827 | Remote Similarity | NPD6914 | Discontinued |
0.5804 | Remote Similarity | NPD3667 | Approved |
0.5789 | Remote Similarity | NPD7100 | Approved |
0.5789 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5763 | Remote Similarity | NPD8034 | Phase 2 |
0.5763 | Remote Similarity | NPD8035 | Phase 2 |
0.5702 | Remote Similarity | NPD4786 | Approved |
0.5683 | Remote Similarity | NPD6033 | Approved |
0.5625 | Remote Similarity | NPD5128 | Approved |
0.561 | Remote Similarity | NPD4225 | Approved |
0.5603 | Remote Similarity | NPD5956 | Approved |
0.56 | Remote Similarity | NPD3653 | Clinical (unspecified phase) |
0.56 | Remote Similarity | NPD5211 | Phase 2 |
PubChem CID   | 127675 |
ChEMBL   | CHEMBL514096 |
ZINC   |
Molecular Weight:   | 383.19 |
ALogP:   | 0.7838 |
MLogP:   | 3 |
XLogP:   | 3.068 |
# Rotatable Bonds:   | 10 |
Polar Surface Area:   | 90.12 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 3 |
# Rings:   | 3 |
# Heavy Atoms:   | 26 |