Natural Product: NPC47288

Natural Product ID:  NPC47288
Common Name:   Strongylophorin-22
IUPAC Name:  
Synonyms:   Strongylophorin-22
Molecular Formula:   C26H38O2
Standard InCHIKey:  RFNMUDSLOPJKMY-TXIQQBFSSA-N
Standard InCHI:  InChI=1S/C26H38O2/c1-23(2)11-6-12-24(3)20(23)9-13-25(4)21(24)10-14-26(5)22(25)16-17-15-18(27)7-8-19(17)28-26/h7-8,15,20-22,27H,6,9-14,16H2,1-5H3/t20-,21+,22-,24-,25+,26-/m0/s1
Canonical SMILES:  Oc1ccc2c(c1)C[C@@H]1[C@](O2)(C)CC[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)CCCC1(C)C
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO24364 Petrosia corticata Species Petrosiidae Eukaryota Okinawan, Japan PMID[14695804]
NPO24364 Petrosia corticata Species Petrosiidae Eukaryota PMID[25987373]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT165 Cell Line HeLa Homo sapiens IC50 = 26600 nM Open TG-GATES in vivo data: Hematology
NPT2 Others Unspecified IC50 < 100000 nM 21493075

  Similar Natural Products in NPASS

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 NPC47288 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
0.9758 High Similarity NPC153019
0.9669 High Similarity NPC248557
0.9603 High Similarity NPC211352
0.9524 High Similarity NPC27578
0.9524 High Similarity NPC289624
0.938 High Similarity NPC474610
0.9262 High Similarity NPC475839
0.9167 High Similarity NPC472794
0.9167 High Similarity NPC76312
0.9167 High Similarity NPC473049
0.9167 High Similarity NPC79372
0.9098 High Similarity NPC472791
0.9098 High Similarity NPC472792
0.9055 High Similarity NPC176590
0.9016 High Similarity NPC51341
0.8952 High Similarity NPC48623
0.8952 High Similarity NPC168707
0.8947 High Similarity NPC265335
0.8898 High Similarity NPC128321
0.8897 High Similarity NPC474599
0.8889 High Similarity NPC61685
0.8871 High Similarity NPC45663
0.8862 High Similarity NPC471449
0.8852 High Similarity NPC187993
0.8852 High Similarity NPC238176
0.877 High Similarity NPC69539
0.8672 High Similarity NPC28476
0.8672 High Similarity NPC133407
0.864 High Similarity NPC474131
0.8636 High Similarity NPC85595
0.8629 High Similarity NPC139047
0.8618 High Similarity NPC141001
0.8561 High Similarity NPC474200
0.856 High Similarity NPC32152
0.855 High Similarity NPC96719
0.855 High Similarity NPC222108
0.8537 High Similarity NPC473718
0.8512 High Similarity NPC77772
0.8507 High Similarity NPC71372
0.8492 Intermediate Similarity NPC232295
0.8485 Intermediate Similarity NPC472793
0.8485 Intermediate Similarity NPC473048
0.8478 Intermediate Similarity NPC323126
0.8478 Intermediate Similarity NPC186033
0.8468 Intermediate Similarity NPC126759
0.8468 Intermediate Similarity NPC242580
0.8468 Intermediate Similarity NPC236070
0.8467 Intermediate Similarity NPC252901
0.8443 Intermediate Similarity NPC177962
0.8443 Intermediate Similarity NPC474920
0.8443 Intermediate Similarity NPC62867
0.8429 Intermediate Similarity NPC90645
0.8425 Intermediate Similarity NPC129176
0.8421 Intermediate Similarity NPC473047
0.8372 Intermediate Similarity NPC261992
0.8361 Intermediate Similarity NPC275627
0.8361 Intermediate Similarity NPC470770
0.8361 Intermediate Similarity NPC266937
0.8346 Intermediate Similarity NPC260832
0.8346 Intermediate Similarity NPC196193
0.8346 Intermediate Similarity NPC135467
0.8308 Intermediate Similarity NPC474237
0.8306 Intermediate Similarity NPC471534
0.8298 Intermediate Similarity NPC472457
0.8295 Intermediate Similarity NPC476332
0.8295 Intermediate Similarity NPC188997
0.8295 Intermediate Similarity NPC473464
0.8295 Intermediate Similarity NPC204535
0.8295 Intermediate Similarity NPC46586
0.8293 Intermediate Similarity NPC98372
0.8284 Intermediate Similarity NPC258073
0.8281 Intermediate Similarity NPC212559
0.8271 Intermediate Similarity NPC206028
0.8268 Intermediate Similarity NPC93071
0.8268 Intermediate Similarity NPC126002
0.8258 Intermediate Similarity NPC186889
0.8258 Intermediate Similarity NPC473134
0.8252 Intermediate Similarity NPC212142
0.8231 Intermediate Similarity NPC474130
0.8222 Intermediate Similarity NPC469611
0.8222 Intermediate Similarity NPC472798
0.8209 Intermediate Similarity NPC249425
0.8201 Intermediate Similarity NPC221134
0.8189 Intermediate Similarity NPC283616
0.8182 Intermediate Similarity NPC320439
0.8175 Intermediate Similarity NPC279463
0.8175 Intermediate Similarity NPC327382
0.8175 Intermediate Similarity NPC471668
0.8168 Intermediate Similarity NPC276962
0.8168 Intermediate Similarity NPC190086
0.8162 Intermediate Similarity NPC469610
0.8154 Intermediate Similarity NPC152946
0.8151 Intermediate Similarity NPC325860
0.8148 Intermediate Similarity NPC8899
0.8148 Intermediate Similarity NPC472590
0.8148 Intermediate Similarity NPC160623
0.8138 Intermediate Similarity NPC195561
0.8138 Intermediate Similarity NPC158784
0.8134 Intermediate Similarity NPC472797
0.8134 Intermediate Similarity NPC210655
0.8134 Intermediate Similarity NPC16577
0.8116 Intermediate Similarity NPC472800
0.8112 Intermediate Similarity NPC471608
0.8106 Intermediate Similarity NPC4286
0.8106 Intermediate Similarity NPC252962
0.8106 Intermediate Similarity NPC76119
0.8092 Intermediate Similarity NPC96940
0.8088 Intermediate Similarity NPC189482
0.8082 Intermediate Similarity NPC2745
0.8082 Intermediate Similarity NPC302915
0.8074 Intermediate Similarity NPC196621
0.8074 Intermediate Similarity NPC475880
0.8062 Intermediate Similarity NPC103916
0.806 Intermediate Similarity NPC223912
0.806 Intermediate Similarity NPC201069
0.8033 Intermediate Similarity NPC233320
0.8031 Intermediate Similarity NPC312105
0.803 Intermediate Similarity NPC147896
0.8029 Intermediate Similarity NPC138940
0.8029 Intermediate Similarity NPC77196
0.8027 Intermediate Similarity NPC157783
0.8015 Intermediate Similarity NPC293203
0.8015 Intermediate Similarity NPC244888
0.8015 Intermediate Similarity NPC211413
0.8015 Intermediate Similarity NPC302211
0.8015 Intermediate Similarity NPC478058
0.8015 Intermediate Similarity NPC118683
0.8015 Intermediate Similarity NPC68205
0.8015 Intermediate Similarity NPC164804
0.8014 Intermediate Similarity NPC474851
0.8014 Intermediate Similarity NPC474850
0.8 Intermediate Similarity NPC100108
0.8 Intermediate Similarity NPC473875
0.8 Intermediate Similarity NPC277798
0.8 Intermediate Similarity NPC266868
0.8 Intermediate Similarity NPC472796
0.8 Intermediate Similarity NPC19869
0.8 Intermediate Similarity NPC472795
0.8 Intermediate Similarity NPC93962
0.7986 Intermediate Similarity NPC471522
0.7985 Intermediate Similarity NPC46978
0.7985 Intermediate Similarity NPC156298
0.7984 Intermediate Similarity NPC141782
0.7984 Intermediate Similarity NPC323074
0.7972 Intermediate Similarity NPC316691
0.7971 Intermediate Similarity NPC473107
0.7971 Intermediate Similarity NPC141023
0.797 Intermediate Similarity NPC124030
0.7956 Intermediate Similarity NPC73656
0.7953 Intermediate Similarity NPC283169
0.7951 Intermediate Similarity NPC53740
0.7951 Intermediate Similarity NPC155072
0.7945 Intermediate Similarity NPC476969
0.7943 Intermediate Similarity NPC198038
0.7941 Intermediate Similarity NPC475102
0.7937 Intermediate Similarity NPC141003
0.7937 Intermediate Similarity NPC35344
0.7933 Intermediate Similarity NPC469507
0.7929 Intermediate Similarity NPC470308
0.7929 Intermediate Similarity NPC470307
0.7929 Intermediate Similarity NPC98804
0.7926 Intermediate Similarity NPC38604
0.7926 Intermediate Similarity NPC81261
0.7926 Intermediate Similarity NPC211179
0.7926 Intermediate Similarity NPC53986
0.7926 Intermediate Similarity NPC38664
0.7923 Intermediate Similarity NPC318581
0.7923 Intermediate Similarity NPC477037
0.7923 Intermediate Similarity NPC325544
0.792 Intermediate Similarity NPC176279
0.792 Intermediate Similarity NPC260323
0.7917 Intermediate Similarity NPC292256
0.7917 Intermediate Similarity NPC471600
0.7914 Intermediate Similarity NPC258780
0.791 Intermediate Similarity NPC26879
0.791 Intermediate Similarity NPC170485
0.791 Intermediate Similarity NPC134431
0.791 Intermediate Similarity NPC156854
0.791 Intermediate Similarity NPC50315
0.791 Intermediate Similarity NPC230479
0.791 Intermediate Similarity NPC283049
0.7908 Intermediate Similarity NPC140346
0.7907 Intermediate Similarity NPC206
0.7895 Intermediate Similarity NPC265413
0.7895 Intermediate Similarity NPC10154
0.7891 Intermediate Similarity NPC469663
0.7891 Intermediate Similarity NPC308828
0.7891 Intermediate Similarity NPC33900
0.7891 Intermediate Similarity NPC290470
0.7891 Intermediate Similarity NPC92
0.7891 Intermediate Similarity NPC154256
0.7883 Intermediate Similarity NPC471517
0.7883 Intermediate Similarity NPC473309
0.7883 Intermediate Similarity NPC474143
0.7883 Intermediate Similarity NPC474246
0.7883 Intermediate Similarity NPC282508
0.7879 Intermediate Similarity NPC150026
0.7879 Intermediate Similarity NPC30462
0.7879 Intermediate Similarity NPC74137
0.7874 Intermediate Similarity NPC195922

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC47288 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
0.8843 High Similarity NPD6671 Approved
0.8468 Intermediate Similarity NPD7340 Approved
0.845 Intermediate Similarity NPD6696 Suspended
0.8258 Intermediate Similarity NPD2861 Phase 2
0.8226 Intermediate Similarity NPD1398 Phase 1
0.8209 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.8134 Intermediate Similarity NPD4625 Phase 3
0.8092 Intermediate Similarity NPD5327 Phase 3
0.8092 Intermediate Similarity NPD4749 Approved
0.7971 Intermediate Similarity NPD6353 Approved
0.7941 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7929 Intermediate Similarity NPD6100 Approved
0.7929 Intermediate Similarity NPD6099 Approved
0.7926 Intermediate Similarity NPD4908 Phase 1
0.791 Intermediate Similarity NPD4624 Approved
0.7899 Intermediate Similarity NPD5735 Approved
0.7857 Intermediate Similarity NPD7635 Approved
0.7826 Intermediate Similarity NPD4140 Approved
0.782 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7737 Intermediate Similarity NPD7095 Approved
0.7714 Intermediate Similarity NPD4097 Suspended
0.7698 Intermediate Similarity NPD4060 Phase 1
0.7692 Intermediate Similarity NPD7644 Approved
0.7686 Intermediate Similarity NPD289 Clinical (unspecified phase)
0.7669 Intermediate Similarity NPD1611 Approved
0.7669 Intermediate Similarity NPD1610 Phase 2
0.7661 Intermediate Similarity NPD968 Approved
0.766 Intermediate Similarity NPD7097 Phase 1
0.7647 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.7626 Intermediate Similarity NPD8032 Phase 2
0.7612 Intermediate Similarity NPD2232 Approved
0.7612 Intermediate Similarity NPD2233 Approved
0.7612 Intermediate Similarity NPD2230 Approved
0.7594 Intermediate Similarity NPD3496 Discontinued
0.7586 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7571 Intermediate Similarity NPD3620 Phase 2
0.7571 Intermediate Similarity NPD3619 Clinical (unspecified phase)
0.7569 Intermediate Similarity NPD7037 Approved
0.7538 Intermediate Similarity NPD7157 Approved
0.7519 Intermediate Similarity NPD4059 Approved
0.7519 Intermediate Similarity NPD4626 Approved
0.7518 Intermediate Similarity NPD6584 Phase 3
0.75 Intermediate Similarity NPD3091 Approved
0.7466 Intermediate Similarity NPD7003 Approved
0.7429 Intermediate Similarity NPD6812 Clinical (unspecified phase)
0.741 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7397 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7397 Intermediate Similarity NPD6674 Discontinued
0.7388 Intermediate Similarity NPD3019 Approved
0.7372 Intermediate Similarity NPD8651 Approved
0.7338 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7338 Intermediate Similarity NPD5929 Approved
0.7338 Intermediate Similarity NPD5736 Approved
0.7333 Intermediate Similarity NPD6273 Approved
0.7333 Intermediate Similarity NPD6090 Discontinued
0.7323 Intermediate Similarity NPD2342 Discontinued
0.7319 Intermediate Similarity NPD2797 Approved
0.7317 Intermediate Similarity NPD3020 Approved
0.7315 Intermediate Similarity NPD7040 Clinical (unspecified phase)
0.7315 Intermediate Similarity NPD7041 Phase 2
0.7313 Intermediate Similarity NPD5585 Approved
0.7313 Intermediate Similarity NPD5691 Approved
0.7308 Intermediate Similarity NPD5535 Approved
0.7305 Intermediate Similarity NPD7294 Phase 1
0.7299 Intermediate Similarity NPD6582 Phase 2
0.7299 Intermediate Similarity NPD6583 Phase 3
0.7295 Intermediate Similarity NPD288 Approved
0.7279 Intermediate Similarity NPD3092 Approved
0.7267 Intermediate Similarity NPD7446 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD4160 Clinical (unspecified phase)
0.7266 Intermediate Similarity NPD2684 Approved
0.726 Intermediate Similarity NPD5763 Approved
0.726 Intermediate Similarity NPD5762 Approved
0.7259 Intermediate Similarity NPD2932 Approved
0.7259 Intermediate Similarity NPD1778 Approved
0.7252 Intermediate Similarity NPD5283 Phase 1
0.7239 Intermediate Similarity NPD1548 Phase 1
0.723 Intermediate Similarity NPD8166 Discontinued
0.7226 Intermediate Similarity NPD2231 Phase 2
0.7226 Intermediate Similarity NPD2235 Phase 2
0.7213 Intermediate Similarity NPD844 Approved
0.7203 Intermediate Similarity NPD3109 Approved
0.7203 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7203 Intermediate Similarity NPD2238 Phase 2
0.7203 Intermediate Similarity NPD1613 Approved
0.7203 Intermediate Similarity NPD3110 Approved
0.7197 Intermediate Similarity NPD7833 Phase 2
0.7197 Intermediate Similarity NPD7832 Clinical (unspecified phase)
0.7197 Intermediate Similarity NPD7831 Phase 2
0.7194 Intermediate Similarity NPD3094 Phase 2
0.7183 Intermediate Similarity NPD7985 Registered
0.7176 Intermediate Similarity NPD7843 Approved
0.7172 Intermediate Similarity NPD7119 Phase 2
0.7161 Intermediate Similarity NPD5722 Discontinued
0.7143 Intermediate Similarity NPD709 Approved
0.7143 Intermediate Similarity NPD7030 Discontinued
0.7143 Intermediate Similarity NPD2346 Discontinued
0.7133 Intermediate Similarity NPD6663 Approved
0.7132 Intermediate Similarity NPD2668 Approved
0.7132 Intermediate Similarity NPD3095 Discontinued
0.7132 Intermediate Similarity NPD2667 Approved
0.7131 Intermediate Similarity NPD1432 Clinical (unspecified phase)
0.7122 Intermediate Similarity NPD1283 Approved
0.7103 Intermediate Similarity NPD2157 Approved
0.7101 Intermediate Similarity NPD1608 Approved
0.7099 Intermediate Similarity NPD228 Approved
0.7092 Intermediate Similarity NPD2237 Approved
0.7092 Intermediate Similarity NPD1712 Approved
0.7078 Intermediate Similarity NPD7458 Discontinued
0.7078 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7077 Intermediate Similarity NPD3022 Approved
0.7077 Intermediate Similarity NPD5451 Approved
0.7077 Intermediate Similarity NPD4750 Phase 3
0.7077 Intermediate Similarity NPD3021 Approved
0.7075 Intermediate Similarity NPD2935 Discontinued
0.7073 Intermediate Similarity NPD2860 Approved
0.7073 Intermediate Similarity NPD1809 Phase 2
0.7073 Intermediate Similarity NPD2859 Approved
0.7071 Intermediate Similarity NPD4098 Discontinued
0.7063 Intermediate Similarity NPD3268 Approved
0.7063 Intermediate Similarity NPD8127 Discontinued
0.7059 Intermediate Similarity NPD3445 Approved
0.7059 Intermediate Similarity NPD1651 Approved
0.7059 Intermediate Similarity NPD3443 Approved
0.7059 Intermediate Similarity NPD3444 Approved
0.7054 Intermediate Similarity NPD290 Approved
0.705 Intermediate Similarity NPD4359 Approved
0.7049 Intermediate Similarity NPD845 Approved
0.7042 Intermediate Similarity NPD2606 Approved
0.7042 Intermediate Similarity NPD2605 Approved
0.7039 Intermediate Similarity NPD7447 Phase 1
0.7034 Intermediate Similarity NPD6355 Discontinued
0.7029 Intermediate Similarity NPD1535 Discovery
0.7015 Intermediate Similarity NPD6387 Discontinued
0.7014 Intermediate Similarity NPD7477 Discontinued
0.7013 Intermediate Similarity NPD2370 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD6029 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD5846 Approved
0.7007 Intermediate Similarity NPD6028 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD6516 Phase 2
0.6993 Remote Similarity NPD5155 Approved
0.6993 Remote Similarity NPD5156 Approved
0.6992 Remote Similarity NPD2934 Approved
0.6992 Remote Similarity NPD2933 Approved
0.6986 Remote Similarity NPD4579 Clinical (unspecified phase)
0.6978 Remote Similarity NPD1481 Phase 2
0.6957 Remote Similarity NPD6959 Discontinued
0.6944 Remote Similarity NPD6798 Discontinued
0.6934 Remote Similarity NPD4093 Discontinued
0.6934 Remote Similarity NPD6382 Discontinued
0.6934 Remote Similarity NPD6830 Clinical (unspecified phase)
0.6933 Remote Similarity NPD2489 Approved
0.6933 Remote Similarity NPD27 Approved
0.6929 Remote Similarity NPD1669 Approved
0.6923 Remote Similarity NPD3594 Approved
0.6923 Remote Similarity NPD3595 Approved
0.6918 Remote Similarity NPD3657 Discovery
0.6918 Remote Similarity NPD5124 Phase 1
0.6918 Remote Similarity NPD5123 Clinical (unspecified phase)
0.6917 Remote Similarity NPD821 Approved
0.6914 Remote Similarity NPD3051 Approved
0.6906 Remote Similarity NPD422 Phase 1
0.6906 Remote Similarity NPD5351 Clinical (unspecified phase)
0.6906 Remote Similarity NPD5350 Clinical (unspecified phase)
0.6906 Remote Similarity NPD1281 Approved
0.6905 Remote Similarity NPD7312 Approved
0.6905 Remote Similarity NPD7311 Approved
0.6905 Remote Similarity NPD7313 Approved
0.6905 Remote Similarity NPD7310 Approved
0.6901 Remote Similarity NPD3690 Phase 2
0.6901 Remote Similarity NPD3691 Phase 2
0.6897 Remote Similarity NPD7265 Discontinued
0.6897 Remote Similarity NPD6233 Phase 2
0.6892 Remote Similarity NPD2799 Discontinued
0.6892 Remote Similarity NPD4108 Discontinued
0.6889 Remote Similarity NPD2557 Approved
0.6887 Remote Similarity NPD7466 Approved
0.6887 Remote Similarity NPD4110 Phase 3
0.6887 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6884 Remote Similarity NPD17 Approved
0.6884 Remote Similarity NPD1751 Approved
0.6879 Remote Similarity NPD7258 Clinical (unspecified phase)
0.6875 Remote Similarity NPD3027 Phase 3
0.6871 Remote Similarity NPD2969 Approved
0.6871 Remote Similarity NPD8051 Clinical (unspecified phase)
0.6871 Remote Similarity NPD2970 Approved
0.6864 Remote Similarity NPD7309 Approved
0.6863 Remote Similarity NPD7213 Phase 3
0.6863 Remote Similarity NPD7212 Phase 2
0.6861 Remote Similarity NPD6581 Approved
0.6861 Remote Similarity NPD7741 Discontinued
0.6861 Remote Similarity NPD6580 Approved
0.6859 Remote Similarity NPD3226 Approved
0.6857 Remote Similarity NPD1840 Phase 2
0.6855 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6853 Remote Similarity NPD3635 Approved
0.6853 Remote Similarity NPD3637 Approved
0.6853 Remote Similarity NPD3636 Approved
0.6849 Remote Similarity NPD5837 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   10385261
ChEMBL   CHEMBL462672
ZINC  

Physicochemical Properties

Molecular Weight:  382.29
ALogP:  1.6899
MLogP:  4.1
XLogP:  9.299
# Rotatable Bonds:  6
Polar Surface Area:  29.46
# H-Bond Aceptor:  0
# H-Bond Donor:  1
# Rings:  5
# Heavy Atoms:  28

Download Data

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Structure MOL file  
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Biological Activities  
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