Natural Product: NPC471841

Natural Product ID:  NPC471841
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C18H8O8
Standard InCHIKey:  ZWDDWFGODIIHBZ-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)16(24)14-6-2-8(20)10(22)4-12(6)26-18(14)17/h1-4,19-22H
Canonical SMILES:  Oc1cc2c(cc1O)oc1c2C(=O)C(=O)c2c1oc1c2cc(c(c1)O)O
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
NPO7806 Polyozellus multiplex Species Thelephoraceae Eukaryota PMID[24601669]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1478 Individual Protein Vascular endothelial growth factor receptor 2 Homo sapiens IC50 = 32000 nM 15217276
NPT737 Cell Line HUVEC Homo sapiens IC50 = 7600 nM 22085418

  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 NPC471841 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
0.9877 High Similarity NPC117450
0.976 High Similarity NPC471842
0.9586 High Similarity NPC71260
0.9405 High Similarity NPC24258
0.9337 High Similarity NPC202470
0.9277 High Similarity NPC470704
0.9226 High Similarity NPC54098
0.9226 High Similarity NPC230619
0.9172 High Similarity NPC82217
0.9172 High Similarity NPC216842
0.9172 High Similarity NPC476640
0.9128 High Similarity NPC47883
0.9123 High Similarity NPC98546
0.9118 High Similarity NPC287243
0.9064 High Similarity NPC8127
0.9064 High Similarity NPC49667
0.9059 High Similarity NPC149846
0.9053 High Similarity NPC476641
0.9053 High Similarity NPC28042
0.9042 High Similarity NPC45449
0.9036 High Similarity NPC238995
0.9012 High Similarity NPC297807
0.9006 High Similarity NPC289244
0.8983 High Similarity NPC60848
0.8982 High Similarity NPC1706
0.8982 High Similarity NPC1755
0.8982 High Similarity NPC39305
0.8982 High Similarity NPC263092
0.8982 High Similarity NPC59295
0.8947 High Similarity NPC30550
0.8947 High Similarity NPC65885
0.8929 High Similarity NPC36320
0.8927 High Similarity NPC295436
0.892 High Similarity NPC248315
0.8864 High Similarity NPC226725
0.8862 High Similarity NPC188486
0.8855 High Similarity NPC196879
0.8848 High Similarity NPC472461
0.8837 High Similarity NPC473834
0.8837 High Similarity NPC277510
0.8824 High Similarity NPC50394
0.8817 High Similarity NPC29411
0.881 High Similarity NPC312056
0.881 High Similarity NPC272722
0.881 High Similarity NPC84515
0.8807 High Similarity NPC154527
0.8793 High Similarity NPC23553
0.8793 High Similarity NPC77179
0.878 High Similarity NPC125300
0.8779 High Similarity NPC28589
0.8779 High Similarity NPC174700
0.8779 High Similarity NPC248593
0.8772 High Similarity NPC247136
0.8757 High Similarity NPC133065
0.875 High Similarity NPC231758
0.875 High Similarity NPC240508
0.8743 High Similarity NPC16935
0.8743 High Similarity NPC476273
0.8735 High Similarity NPC45131
0.8713 High Similarity NPC86477
0.8713 High Similarity NPC95715
0.8706 High Similarity NPC39306
0.8706 High Similarity NPC291110
0.8693 High Similarity NPC475996
0.8686 High Similarity NPC221820
0.8678 High Similarity NPC245975
0.8652 High Similarity NPC304322
0.8644 High Similarity NPC246153
0.8644 High Similarity NPC228209
0.8631 High Similarity NPC193842
0.8631 High Similarity NPC195832
0.8623 High Similarity NPC268161
0.8621 High Similarity NPC37606
0.8613 High Similarity NPC218533
0.8613 High Similarity NPC78830
0.8605 High Similarity NPC247973
0.8605 High Similarity NPC241820
0.8603 High Similarity NPC139683
0.8603 High Similarity NPC47905
0.8603 High Similarity NPC73929
0.8596 High Similarity NPC476170
0.8596 High Similarity NPC37183
0.8571 High Similarity NPC305663
0.8571 High Similarity NPC78302
0.8571 High Similarity NPC176665
0.8571 High Similarity NPC163524
0.8571 High Similarity NPC472438
0.8571 High Similarity NPC29841
0.8571 High Similarity NPC235215
0.8571 High Similarity NPC290304
0.8571 High Similarity NPC287979
0.8571 High Similarity NPC7973
0.8571 High Similarity NPC185526
0.8571 High Similarity NPC236327
0.8554 High Similarity NPC27208
0.8547 High Similarity NPC277480
0.8547 High Similarity NPC272560
0.8545 High Similarity NPC248102
0.8545 High Similarity NPC260582
0.8539 High Similarity NPC8927
0.8538 High Similarity NPC110257
0.8523 High Similarity NPC156955
0.8521 High Similarity NPC7846
0.8521 High Similarity NPC288669
0.8521 High Similarity NPC115798
0.8521 High Similarity NPC143828
0.8521 High Similarity NPC18772
0.8521 High Similarity NPC18607
0.8521 High Similarity NPC105242
0.8521 High Similarity NPC261004
0.8521 High Similarity NPC130894
0.8521 High Similarity NPC300943
0.8521 High Similarity NPC253634
0.8521 High Similarity NPC176300
0.8521 High Similarity NPC4481
0.8521 High Similarity NPC191459
0.8521 High Similarity NPC22472
0.8521 High Similarity NPC25495
0.8521 High Similarity NPC204854
0.8521 High Similarity NPC9609
0.8521 High Similarity NPC19687
0.8521 High Similarity NPC152166
0.8514 High Similarity NPC310794
0.8514 High Similarity NPC261471
0.8512 High Similarity NPC43243
0.8512 High Similarity NPC100916
0.8512 High Similarity NPC200388
0.8512 High Similarity NPC55619
0.8512 High Similarity NPC247017
0.8512 High Similarity NPC245546
0.8512 High Similarity NPC98661
0.8512 High Similarity NPC474520
0.8512 High Similarity NPC266960
0.85 High Similarity NPC240808
0.8494 Intermediate Similarity NPC251110
0.8494 Intermediate Similarity NPC171010
0.8494 Intermediate Similarity NPC225731
0.8488 Intermediate Similarity NPC187923
0.8488 Intermediate Similarity NPC38914
0.8476 Intermediate Similarity NPC207729
0.8475 Intermediate Similarity NPC475783
0.8475 Intermediate Similarity NPC246877
0.8471 Intermediate Similarity NPC246478
0.8466 Intermediate Similarity NPC227906
0.8462 Intermediate Similarity NPC227192
0.8462 Intermediate Similarity NPC203891
0.8462 Intermediate Similarity NPC101830
0.8462 Intermediate Similarity NPC75215
0.8462 Intermediate Similarity NPC189179
0.8462 Intermediate Similarity NPC224137
0.8462 Intermediate Similarity NPC93376
0.8462 Intermediate Similarity NPC110070
0.8452 Intermediate Similarity NPC201451
0.8452 Intermediate Similarity NPC26227
0.8452 Intermediate Similarity NPC214138
0.8452 Intermediate Similarity NPC44079
0.8452 Intermediate Similarity NPC208197
0.8448 Intermediate Similarity NPC280493
0.8448 Intermediate Similarity NPC211309
0.8443 Intermediate Similarity NPC142540
0.8443 Intermediate Similarity NPC101996
0.8443 Intermediate Similarity NPC161277
0.8443 Intermediate Similarity NPC39007
0.8443 Intermediate Similarity NPC123886
0.8443 Intermediate Similarity NPC304954
0.8434 Intermediate Similarity NPC45873
0.8434 Intermediate Similarity NPC61620
0.8434 Intermediate Similarity NPC77858
0.843 Intermediate Similarity NPC89131
0.843 Intermediate Similarity NPC41301
0.843 Intermediate Similarity NPC470459
0.8427 Intermediate Similarity NPC183843
0.8424 Intermediate Similarity NPC194856
0.8424 Intermediate Similarity NPC19545
0.8421 Intermediate Similarity NPC196179
0.8421 Intermediate Similarity NPC258331
0.8421 Intermediate Similarity NPC34089
0.8421 Intermediate Similarity NPC308992
0.8421 Intermediate Similarity NPC304387
0.8418 Intermediate Similarity NPC164384
0.8412 Intermediate Similarity NPC190487
0.8412 Intermediate Similarity NPC154304
0.8412 Intermediate Similarity NPC472877
0.8412 Intermediate Similarity NPC55738
0.8402 Intermediate Similarity NPC474638
0.8402 Intermediate Similarity NPC138243
0.8402 Intermediate Similarity NPC292107
0.8402 Intermediate Similarity NPC49824
0.8402 Intermediate Similarity NPC178854
0.8402 Intermediate Similarity NPC265511
0.8402 Intermediate Similarity NPC137100
0.8402 Intermediate Similarity NPC274730
0.84 Intermediate Similarity NPC131866
0.8393 Intermediate Similarity NPC167091
0.8393 Intermediate Similarity NPC88645
0.8393 Intermediate Similarity NPC250822
0.8393 Intermediate Similarity NPC58382
0.8393 Intermediate Similarity NPC276409
0.8393 Intermediate Similarity NPC206238
0.8393 Intermediate Similarity NPC246204

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC471841 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
0.8402 Intermediate Similarity NPD3882 Suspended
0.8284 Intermediate Similarity NPD2801 Approved
0.8218 Intermediate Similarity NPD3926 Phase 2
0.8208 Intermediate Similarity NPD1247 Approved
0.8193 Intermediate Similarity NPD1512 Approved
0.8171 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.8171 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8171 Intermediate Similarity NPD6166 Phase 2
0.8118 Intermediate Similarity NPD1934 Approved
0.8079 Intermediate Similarity NPD3818 Discontinued
0.8072 Intermediate Similarity NPD1511 Approved
0.7977 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7965 Intermediate Similarity NPD1465 Phase 2
0.7956 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7955 Intermediate Similarity NPD6232 Discontinued
0.7931 Intermediate Similarity NPD3749 Approved
0.7921 Intermediate Similarity NPD7473 Discontinued
0.7919 Intermediate Similarity NPD3817 Phase 2
0.7861 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7845 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7841 Intermediate Similarity NPD5494 Approved
0.7711 Intermediate Similarity NPD2344 Approved
0.7697 Intermediate Similarity NPD6959 Discontinued
0.7684 Intermediate Similarity NPD919 Approved
0.765 Intermediate Similarity NPD6797 Phase 2
0.7637 Intermediate Similarity NPD5844 Phase 1
0.7627 Intermediate Similarity NPD7075 Discontinued
0.7614 Intermediate Similarity NPD5402 Approved
0.7609 Intermediate Similarity NPD6559 Discontinued
0.7609 Intermediate Similarity NPD7251 Discontinued
0.7602 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7596 Intermediate Similarity NPD7074 Phase 3
0.7568 Intermediate Similarity NPD7808 Phase 3
0.7541 Intermediate Similarity NPD7054 Approved
0.7529 Intermediate Similarity NPD2309 Approved
0.7515 Intermediate Similarity NPD2800 Approved
0.7514 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD6801 Discontinued
0.75 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD7472 Approved
0.7486 Intermediate Similarity NPD6599 Discontinued
0.7486 Intermediate Similarity NPD4380 Phase 2
0.7473 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7458 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7456 Intermediate Similarity NPD1549 Phase 2
0.7455 Intermediate Similarity NPD943 Approved
0.7443 Intermediate Similarity NPD7411 Suspended
0.7442 Intermediate Similarity NPD6799 Approved
0.743 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7429 Intermediate Similarity NPD3226 Approved
0.7421 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7418 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7396 Intermediate Similarity NPD1471 Phase 3
0.7396 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7396 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7391 Intermediate Similarity NPD3751 Discontinued
0.7389 Intermediate Similarity NPD6234 Discontinued
0.7381 Intermediate Similarity NPD1510 Phase 2
0.7354 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7316 Intermediate Similarity NPD8434 Phase 2
0.7314 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7278 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7263 Intermediate Similarity NPD7819 Suspended
0.7262 Intermediate Similarity NPD1607 Approved
0.7258 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7254 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7246 Intermediate Similarity NPD1240 Approved
0.7216 Intermediate Similarity NPD920 Approved
0.7216 Intermediate Similarity NPD5403 Approved
0.7213 Intermediate Similarity NPD7199 Phase 2
0.7209 Intermediate Similarity NPD1243 Approved
0.72 Intermediate Similarity NPD5401 Approved
0.7182 Intermediate Similarity NPD4966 Approved
0.7182 Intermediate Similarity NPD4967 Phase 2
0.7182 Intermediate Similarity NPD7768 Phase 2
0.7182 Intermediate Similarity NPD4965 Approved
0.7176 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7168 Intermediate Similarity NPD3750 Approved
0.7152 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7390 Discontinued
0.7135 Intermediate Similarity NPD2796 Approved
0.7126 Intermediate Similarity NPD6190 Approved
0.7112 Intermediate Similarity NPD7228 Approved
0.7108 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7104 Intermediate Similarity NPD5537 Clinical (unspecified phase)
0.7102 Intermediate Similarity NPD2533 Approved
0.7102 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7102 Intermediate Similarity NPD2532 Approved
0.7102 Intermediate Similarity NPD2534 Approved
0.7097 Intermediate Similarity NPD2403 Approved
0.7081 Intermediate Similarity NPD3787 Discontinued
0.7062 Intermediate Similarity NPD4287 Approved
0.7052 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7045 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7033 Intermediate Similarity NPD2296 Approved
0.7017 Intermediate Similarity NPD37 Approved
0.7011 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD230 Phase 1
0.7 Intermediate Similarity NPD447 Suspended
0.6989 Remote Similarity NPD643 Clinical (unspecified phase)
0.6941 Remote Similarity NPD1612 Clinical (unspecified phase)
0.6941 Remote Similarity NPD1613 Approved
0.6936 Remote Similarity NPD2935 Discontinued
0.6936 Remote Similarity NPD1551 Phase 2
0.6915 Remote Similarity NPD6778 Approved
0.6915 Remote Similarity NPD6782 Approved
0.6915 Remote Similarity NPD6780 Approved
0.6915 Remote Similarity NPD6777 Approved
0.6915 Remote Similarity NPD6781 Approved
0.6915 Remote Similarity NPD6776 Approved
0.6915 Remote Similarity NPD6779 Approved
0.691 Remote Similarity NPD7422 Clinical (unspecified phase)
0.6897 Remote Similarity NPD7435 Discontinued
0.6891 Remote Similarity NPD8312 Approved
0.6891 Remote Similarity NPD8313 Approved
0.6879 Remote Similarity NPD3748 Approved
0.6842 Remote Similarity NPD2163 Approved
0.6842 Remote Similarity NPD7893 Clinical (unspecified phase)
0.6839 Remote Similarity NPD6099 Approved
0.6839 Remote Similarity NPD6100 Approved
0.6812 Remote Similarity NPD8151 Discontinued
0.68 Remote Similarity NPD2346 Discontinued
0.6796 Remote Similarity NPD1653 Approved
0.678 Remote Similarity NPD7871 Phase 2
0.678 Remote Similarity NPD7870 Phase 2
0.678 Remote Similarity NPD4628 Phase 3
0.6776 Remote Similarity NPD7907 Approved
0.6766 Remote Similarity NPD8090 Clinical (unspecified phase)
0.6763 Remote Similarity NPD6651 Approved
0.6736 Remote Similarity NPD5953 Discontinued
0.6732 Remote Similarity NPD7696 Phase 3
0.6732 Remote Similarity NPD7698 Approved
0.6732 Remote Similarity NPD7697 Approved
0.6726 Remote Similarity NPD1470 Approved
0.6725 Remote Similarity NPD3764 Approved
0.6725 Remote Similarity NPD2313 Discontinued
0.6722 Remote Similarity NPD7004 Clinical (unspecified phase)
0.672 Remote Similarity NPD6808 Phase 2
0.6705 Remote Similarity NPD2343 Clinical (unspecified phase)
0.6701 Remote Similarity NPD8150 Discontinued
0.6701 Remote Similarity NPD7240 Approved
0.6699 Remote Similarity NPD7874 Approved
0.6699 Remote Similarity NPD7875 Clinical (unspecified phase)
0.6686 Remote Similarity NPD2799 Discontinued
0.6685 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6685 Remote Similarity NPD6398 Clinical (unspecified phase)
0.6683 Remote Similarity NPD7701 Phase 2
0.6682 Remote Similarity NPD4665 Approved
0.6682 Remote Similarity NPD4111 Phase 1
0.6667 Remote Similarity NPD3027 Phase 3
0.6667 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6667 Remote Similarity NPD6535 Approved
0.6667 Remote Similarity NPD6534 Approved
0.6649 Remote Similarity NPD6279 Approved
0.6649 Remote Similarity NPD6280 Approved
0.6648 Remote Similarity NPD5404 Approved
0.6648 Remote Similarity NPD5408 Approved
0.6648 Remote Similarity NPD5405 Approved
0.6648 Remote Similarity NPD5406 Approved
0.6647 Remote Similarity NPD9269 Phase 2
0.6647 Remote Similarity NPD9494 Approved
0.6632 Remote Similarity NPD7286 Phase 2
0.6632 Remote Similarity NPD5710 Approved
0.6632 Remote Similarity NPD5711 Approved
0.6632 Remote Similarity NPD7229 Phase 3
0.6627 Remote Similarity NPD1203 Approved
0.6615 Remote Similarity NPD7685 Pre-registration
0.6613 Remote Similarity NPD5760 Phase 2
0.6613 Remote Similarity NPD5761 Phase 2
0.6609 Remote Similarity NPD1933 Approved
0.6607 Remote Similarity NPD4379 Clinical (unspecified phase)
0.6599 Remote Similarity NPD7090 Clinical (unspecified phase)
0.659 Remote Similarity NPD6233 Phase 2
0.6588 Remote Similarity NPD7783 Phase 2
0.6588 Remote Similarity NPD7782 Clinical (unspecified phase)
0.6588 Remote Similarity NPD7801 Approved
0.6569 Remote Similarity NPD7700 Phase 2
0.6569 Remote Similarity NPD7699 Phase 2
0.6562 Remote Similarity NPD4575 Clinical (unspecified phase)
0.6553 Remote Similarity NPD2493 Approved
0.6553 Remote Similarity NPD3450 Approved
0.6553 Remote Similarity NPD2494 Approved
0.6553 Remote Similarity NPD3452 Approved
0.6532 Remote Similarity NPD6798 Discontinued
0.6532 Remote Similarity NPD3268 Approved
0.6532 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6512 Remote Similarity NPD4908 Phase 1
0.651 Remote Similarity NPD5242 Approved
0.649 Remote Similarity NPD7680 Approved
0.649 Remote Similarity NPD4004 Approved
0.649 Remote Similarity NPD4002 Approved
0.6488 Remote Similarity NPD1201 Approved
0.6486 Remote Similarity NPD5808 Clinical (unspecified phase)
0.6468 Remote Similarity NPD8155 Clinical (unspecified phase)
0.6464 Remote Similarity NPD2354 Approved
0.6459 Remote Similarity NPD4583 Approved
0.6459 Remote Similarity NPD4582 Approved
0.6456 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6442 Remote Similarity NPD6823 Phase 2

Structure

External Identifiers

PubChem CID  
ChEMBL   CHEMBL3236669
ZINC  

Physicochemical Properties

Molecular Weight:  352.02
ALogP:  -2.677
MLogP:  2.56
XLogP:  0.284
# Rotatable Bonds:  4
Polar Surface Area:  141.34
# H-Bond Aceptor:  2
# H-Bond Donor:  4
# Rings:  5
# Heavy Atoms:  26

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs