Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT111 | Cell Line | K562 | Homo sapiens | IC50 | = | 11300 | nM | 12825928 |
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 NPC469466 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 |
---|---|---|
0.9048 | High Similarity | NPC236644 |
0.8899 | High Similarity | NPC76660 |
0.8899 | High Similarity | NPC276995 |
0.8584 | High Similarity | NPC209734 |
0.8165 | Intermediate Similarity | NPC265094 |
0.8036 | Intermediate Similarity | NPC15413 |
0.8017 | Intermediate Similarity | NPC474371 |
0.7143 | Intermediate Similarity | NPC128246 |
0.713 | Intermediate Similarity | NPC203170 |
0.7115 | Intermediate Similarity | NPC126248 |
0.708 | Intermediate Similarity | NPC57976 |
0.6972 | Remote Similarity | NPC207114 |
0.6972 | Remote Similarity | NPC217983 |
0.6944 | Remote Similarity | NPC187661 |
0.6916 | Remote Similarity | NPC224386 |
0.6916 | Remote Similarity | NPC194859 |
0.6909 | Remote Similarity | NPC38392 |
0.6891 | Remote Similarity | NPC271562 |
0.6847 | Remote Similarity | NPC19087 |
0.6846 | Remote Similarity | NPC476951 |
0.6822 | Remote Similarity | NPC111409 |
0.6786 | Remote Similarity | NPC184063 |
0.6786 | Remote Similarity | NPC475925 |
0.6772 | Remote Similarity | NPC230849 |
0.6746 | Remote Similarity | NPC476952 |
0.6726 | Remote Similarity | NPC475788 |
0.6696 | Remote Similarity | NPC471843 |
0.6696 | Remote Similarity | NPC297474 |
0.6696 | Remote Similarity | NPC54065 |
0.6693 | Remote Similarity | NPC35037 |
0.6667 | Remote Similarity | NPC471844 |
0.6641 | Remote Similarity | NPC11379 |
0.6637 | Remote Similarity | NPC293001 |
0.6637 | Remote Similarity | NPC171360 |
0.6637 | Remote Similarity | NPC29821 |
0.6637 | Remote Similarity | NPC63193 |
0.6637 | Remote Similarity | NPC35959 |
0.6637 | Remote Similarity | NPC133888 |
0.6637 | Remote Similarity | NPC57304 |
0.6617 | Remote Similarity | NPC470539 |
0.6607 | Remote Similarity | NPC155935 |
0.6607 | Remote Similarity | NPC215556 |
0.6574 | Remote Similarity | NPC246076 |
0.6557 | Remote Similarity | NPC70235 |
0.6552 | Remote Similarity | NPC474297 |
0.6549 | Remote Similarity | NPC35809 |
0.6549 | Remote Similarity | NPC216284 |
0.6542 | Remote Similarity | NPC258965 |
0.6542 | Remote Similarity | NPC156658 |
0.6518 | Remote Similarity | NPC79549 |
0.6512 | Remote Similarity | NPC88190 |
0.6496 | Remote Similarity | NPC474313 |
0.6496 | Remote Similarity | NPC476344 |
0.6486 | Remote Similarity | NPC56593 |
0.6484 | Remote Similarity | NPC174463 |
0.6484 | Remote Similarity | NPC235625 |
0.6466 | Remote Similarity | NPC476053 |
0.6466 | Remote Similarity | NPC472873 |
0.6466 | Remote Similarity | NPC150041 |
0.6435 | Remote Similarity | NPC258216 |
0.6429 | Remote Similarity | NPC118601 |
0.641 | Remote Similarity | NPC91771 |
0.641 | Remote Similarity | NPC24956 |
0.641 | Remote Similarity | NPC18019 |
0.641 | Remote Similarity | NPC142529 |
0.6396 | Remote Similarity | NPC300082 |
0.6396 | Remote Similarity | NPC284534 |
0.6396 | Remote Similarity | NPC204105 |
0.6389 | Remote Similarity | NPC51507 |
0.6379 | Remote Similarity | NPC198853 |
0.6379 | Remote Similarity | NPC473331 |
0.6372 | Remote Similarity | NPC178875 |
0.6356 | Remote Similarity | NPC471150 |
0.6356 | Remote Similarity | NPC304445 |
0.6356 | Remote Similarity | NPC236580 |
0.635 | Remote Similarity | NPC133089 |
0.6348 | Remote Similarity | NPC155215 |
0.6339 | Remote Similarity | NPC304558 |
0.6339 | Remote Similarity | NPC64153 |
0.6333 | Remote Similarity | NPC67296 |
0.6325 | Remote Similarity | NPC213698 |
0.6325 | Remote Similarity | NPC170120 |
0.6325 | Remote Similarity | NPC163228 |
0.6303 | Remote Similarity | NPC249171 |
0.6303 | Remote Similarity | NPC49833 |
0.6296 | Remote Similarity | NPC173173 |
0.6293 | Remote Similarity | NPC200237 |
0.6283 | Remote Similarity | NPC475773 |
0.6283 | Remote Similarity | NPC24728 |
0.6281 | Remote Similarity | NPC80144 |
0.6281 | Remote Similarity | NPC86077 |
0.6269 | Remote Similarity | NPC309525 |
0.625 | Remote Similarity | NPC90476 |
0.625 | Remote Similarity | NPC69374 |
0.6239 | Remote Similarity | NPC470010 |
0.6239 | Remote Similarity | NPC127019 |
0.6239 | Remote Similarity | NPC262133 |
0.6239 | Remote Similarity | NPC323008 |
0.6239 | Remote Similarity | NPC470013 |
0.623 | Remote Similarity | NPC215988 |
0.6228 | Remote Similarity | NPC471149 |
0.6222 | Remote Similarity | NPC317654 |
0.6222 | Remote Similarity | NPC96010 |
0.6222 | Remote Similarity | NPC470537 |
0.6222 | Remote Similarity | NPC280903 |
0.6218 | Remote Similarity | NPC311904 |
0.6218 | Remote Similarity | NPC263674 |
0.6218 | Remote Similarity | NPC181151 |
0.6218 | Remote Similarity | NPC261372 |
0.6218 | Remote Similarity | NPC58267 |
0.6218 | Remote Similarity | NPC161493 |
0.6212 | Remote Similarity | NPC23963 |
0.6212 | Remote Similarity | NPC476504 |
0.6207 | Remote Similarity | NPC133698 |
0.6207 | Remote Similarity | NPC131209 |
0.6204 | Remote Similarity | NPC478139 |
0.6204 | Remote Similarity | NPC477988 |
0.6202 | Remote Similarity | NPC471845 |
0.6202 | Remote Similarity | NPC241294 |
0.6202 | Remote Similarity | NPC471846 |
0.6202 | Remote Similarity | NPC202722 |
0.6202 | Remote Similarity | NPC39041 |
0.6198 | Remote Similarity | NPC171759 |
0.6198 | Remote Similarity | NPC150923 |
0.6195 | Remote Similarity | NPC470242 |
0.6195 | Remote Similarity | NPC309757 |
0.6195 | Remote Similarity | NPC236692 |
0.6194 | Remote Similarity | NPC477985 |
0.6194 | Remote Similarity | NPC326386 |
0.6194 | Remote Similarity | NPC471087 |
0.6186 | Remote Similarity | NPC67584 |
0.6186 | Remote Similarity | NPC52044 |
0.6186 | Remote Similarity | NPC304886 |
0.6176 | Remote Similarity | NPC471086 |
0.6174 | Remote Similarity | NPC283409 |
0.6174 | Remote Similarity | NPC472872 |
0.6154 | Remote Similarity | NPC153590 |
0.6154 | Remote Similarity | NPC60386 |
0.6154 | Remote Similarity | NPC473263 |
0.6154 | Remote Similarity | NPC473273 |
0.6154 | Remote Similarity | NPC308656 |
0.6154 | Remote Similarity | NPC473234 |
0.6154 | Remote Similarity | NPC65045 |
0.6142 | Remote Similarity | NPC470534 |
0.614 | Remote Similarity | NPC186148 |
0.6134 | Remote Similarity | NPC213078 |
0.6129 | Remote Similarity | NPC195841 |
0.6129 | Remote Similarity | NPC233256 |
0.6119 | Remote Similarity | NPC477990 |
0.6119 | Remote Similarity | NPC323168 |
0.6119 | Remote Similarity | NPC477989 |
0.6119 | Remote Similarity | NPC111162 |
0.6119 | Remote Similarity | NPC293550 |
0.6116 | Remote Similarity | NPC186861 |
0.6116 | Remote Similarity | NPC471381 |
0.6107 | Remote Similarity | NPC471109 |
0.6102 | Remote Similarity | NPC477131 |
0.6098 | Remote Similarity | NPC473148 |
0.6094 | Remote Similarity | NPC23967 |
0.609 | Remote Similarity | NPC238323 |
0.6087 | Remote Similarity | NPC58219 |
0.6087 | Remote Similarity | NPC307165 |
0.6087 | Remote Similarity | NPC177629 |
0.6087 | Remote Similarity | NPC91248 |
0.6087 | Remote Similarity | NPC215507 |
0.6074 | Remote Similarity | NPC476503 |
0.6074 | Remote Similarity | NPC469999 |
0.6071 | Remote Similarity | NPC245665 |
0.6068 | Remote Similarity | NPC286341 |
0.6068 | Remote Similarity | NPC191339 |
0.6066 | Remote Similarity | NPC474348 |
0.6066 | Remote Similarity | NPC188785 |
0.6063 | Remote Similarity | NPC473232 |
0.6058 | Remote Similarity | NPC478136 |
0.6058 | Remote Similarity | NPC5714 |
0.6053 | Remote Similarity | NPC162071 |
0.6053 | Remote Similarity | NPC67493 |
0.605 | Remote Similarity | NPC40663 |
0.6047 | Remote Similarity | NPC193471 |
0.6047 | Remote Similarity | NPC130124 |
0.6043 | Remote Similarity | NPC120335 |
0.6034 | Remote Similarity | NPC92974 |
0.6034 | Remote Similarity | NPC12872 |
0.6034 | Remote Similarity | NPC168679 |
0.6033 | Remote Similarity | NPC45125 |
0.6033 | Remote Similarity | NPC221615 |
0.6017 | Remote Similarity | NPC472874 |
0.6017 | Remote Similarity | NPC469998 |
0.6017 | Remote Similarity | NPC135776 |
0.6 | Remote Similarity | NPC44004 |
0.6 | Remote Similarity | NPC190753 |
0.6 | Remote Similarity | NPC475217 |
0.6 | Remote Similarity | NPC471380 |
0.6 | Remote Similarity | NPC54737 |
0.6 | Remote Similarity | NPC237540 |
0.6 | Remote Similarity | NPC270270 |
0.5985 | Remote Similarity | NPC106791 |
0.5985 | Remote Similarity | NPC201889 |
0.5984 | Remote Similarity | NPC70865 |
0.5983 | Remote Similarity | NPC37607 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC469466 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 |
---|---|---|---|
0.6462 | Remote Similarity | NPD8266 | Approved |
0.6462 | Remote Similarity | NPD8267 | Approved |
0.6462 | Remote Similarity | NPD8268 | Approved |
0.6462 | Remote Similarity | NPD8269 | Approved |
0.5938 | Remote Similarity | NPD6420 | Discontinued |
0.5913 | Remote Similarity | NPD4249 | Approved |
0.5909 | Remote Similarity | NPD617 | Approved |
0.5891 | Remote Similarity | NPD2204 | Approved |
0.5882 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.5862 | Remote Similarity | NPD4250 | Approved |
0.5862 | Remote Similarity | NPD4251 | Approved |
0.5789 | Remote Similarity | NPD5362 | Discontinued |
0.5778 | Remote Similarity | NPD8347 | Approved |
0.5778 | Remote Similarity | NPD8345 | Approved |
0.5778 | Remote Similarity | NPD8346 | Approved |
0.5766 | Remote Similarity | NPD7122 | Discontinued |
0.5763 | Remote Similarity | NPD1695 | Approved |
0.5725 | Remote Similarity | NPD8340 | Approved |
0.5725 | Remote Similarity | NPD8342 | Approved |
0.5725 | Remote Similarity | NPD8341 | Approved |
0.5725 | Remote Similarity | NPD8299 | Approved |
0.5704 | Remote Similarity | NPD2101 | Approved |
0.5704 | Remote Similarity | NPD7518 | Approved |
0.5704 | Remote Similarity | NPD7517 | Approved |
0.5704 | Remote Similarity | NPD7519 | Approved |
0.5703 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.5692 | Remote Similarity | NPD8087 | Discontinued |
0.5692 | Remote Similarity | NPD6421 | Discontinued |
0.5691 | Remote Similarity | NPD3713 | Approved |
0.5691 | Remote Similarity | NPD3715 | Approved |
0.5691 | Remote Similarity | NPD3714 | Approved |
0.5683 | Remote Similarity | NPD8273 | Phase 1 |
0.5672 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5662 | Remote Similarity | NPD7148 | Clinical (unspecified phase) |
0.5662 | Remote Similarity | NPD7147 | Phase 3 |
0.563 | Remote Similarity | NPD7641 | Discontinued |
0.5614 | Remote Similarity | NPD4790 | Discontinued |
PubChem CID   | 46183621 |
ChEMBL   | CHEMBL1079457 |
ZINC   |
Molecular Weight:   | 361.19 |
ALogP:   | -0.3661 |
MLogP:   | 3 |
XLogP:   | 0.902 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 84.86 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 2 |
# Rings:   | 4 |
# Heavy Atoms:   | 26 |