Natural Product: NPC168259

Natural Product ID:  NPC168259
Common Name:   5,7-Dihydroxy-4-Phenylchromen-2-One
IUPAC Name:   5,7-dihydroxy-4-phenylchromen-2-one
Synonyms:  
Molecular Formula:   C15H10O4
Standard InCHIKey:  HUQKUJNSVHEHIH-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C15H10O4/c16-10-6-12(17)15-11(9-4-2-1-3-5-9)8-14(18)19-13(15)7-10/h1-8,16-17H
Canonical SMILES:  Oc1cc(O)c2c(c1)oc(=O)cc2c1ccccc1
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
NPO25102 Goniobranchus kuniei Species Chromodorididae Eukaryota UNPD*
NPO1626 Primnoa reseda Species Primnoidae Eukaryota UNPD*
NPO12712 Cereus bridgesii Species Sagartiidae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT235 Individual Protein C-C chemokine receptor type 4 Homo sapiens Inhibition = 18.62 % 20099827
NPT53 Individual Protein 4'-phosphopantetheinyl transferase ffp Bacillus subtilis Potency = 89125.1 nM PubChem BioAssay data set
NPT443 Individual Protein Histone acetyltransferase GCN5 Homo sapiens Potency 39810.7 nM PubChem BioAssay data set
NPT64 Individual Protein ATPase family AAA domain-containing protein 5 Homo sapiens Potency 12589.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 28183.8 nM PubChem BioAssay data set
NPT4770 Individual Protein High-affinity choline transporter Homo sapiens IC50 13665.23 nM PubChem BioAssay data set
NPT478 Individual Protein Ataxin-2 Homo sapiens Potency 1995.3 nM PubChem BioAssay data set
NPT1043 Individual Protein Glycoprotein hormones alpha chain Homo sapiens Potency 1000 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 18356.4 nM PubChem BioAssay data set
NPT920 Individual Protein Alpha-synuclein Homo sapiens Potency 11220.2 nM PubChem BioAssay data set
NPT535 Individual Protein Parathyroid hormone receptor Homo sapiens Potency 25118.9 nM PubChem BioAssay data set
NPT105 Individual Protein Muscleblind-like protein 1 Homo sapiens Potency 35481.3 nM PubChem BioAssay data set

  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 NPC168259 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
0.9593 High Similarity NPC32463
0.9496 High Similarity NPC52247
0.9496 High Similarity NPC187868
0.9412 High Similarity NPC302107
0.9344 High Similarity NPC244495
0.9344 High Similarity NPC93219
0.9339 High Similarity NPC315807
0.9328 High Similarity NPC247553
0.9291 High Similarity NPC131950
0.9286 High Similarity NPC307289
0.9206 High Similarity NPC250727
0.9194 High Similarity NPC243688
0.9134 High Similarity NPC281558
0.9077 High Similarity NPC38874
0.9077 High Similarity NPC474886
0.9 High Similarity NPC96705
0.9 High Similarity NPC152306
0.9 High Similarity NPC74821
0.8984 High Similarity NPC194277
0.8968 High Similarity NPC185066
0.8926 High Similarity NPC298796
0.8926 High Similarity NPC295259
0.8915 High Similarity NPC163557
0.8898 High Similarity NPC474289
0.8889 High Similarity NPC258567
0.8889 High Similarity NPC121740
0.8889 High Similarity NPC224774
0.8872 High Similarity NPC170812
0.8872 High Similarity NPC183642
0.8872 High Similarity NPC310370
0.8871 High Similarity NPC472518
0.8862 High Similarity NPC190454
0.8862 High Similarity NPC97432
0.8852 High Similarity NPC258979
0.8852 High Similarity NPC8283
0.8852 High Similarity NPC93398
0.8843 High Similarity NPC265547
0.8819 High Similarity NPC469453
0.8819 High Similarity NPC219923
0.88 High Similarity NPC140521
0.88 High Similarity NPC111347
0.88 High Similarity NPC73413
0.88 High Similarity NPC201667
0.8797 High Similarity NPC71903
0.879 High Similarity NPC96286
0.879 High Similarity NPC257188
0.879 High Similarity NPC13007
0.879 High Similarity NPC248429
0.878 High Similarity NPC319378
0.878 High Similarity NPC163200
0.877 High Similarity NPC281356
0.8769 High Similarity NPC31849
0.8741 High Similarity NPC91492
0.8741 High Similarity NPC7439
0.8741 High Similarity NPC256555
0.8741 High Similarity NPC34245
0.8741 High Similarity NPC110067
0.873 High Similarity NPC249836
0.8722 High Similarity NPC144512
0.8722 High Similarity NPC137262
0.8722 High Similarity NPC47040
0.8722 High Similarity NPC35501
0.8722 High Similarity NPC278600
0.8722 High Similarity NPC37428
0.872 High Similarity NPC76465
0.872 High Similarity NPC273772
0.872 High Similarity NPC154176
0.872 High Similarity NPC109675
0.872 High Similarity NPC290605
0.872 High Similarity NPC173350
0.872 High Similarity NPC38761
0.8712 High Similarity NPC223616
0.871 High Similarity NPC54972
0.871 High Similarity NPC193364
0.871 High Similarity NPC144418
0.8702 High Similarity NPC326600
0.8702 High Similarity NPC204353
0.8702 High Similarity NPC50896
0.8692 High Similarity NPC113006
0.8692 High Similarity NPC19157
0.8682 High Similarity NPC113098
0.8678 High Similarity NPC128633
0.8676 High Similarity NPC471824
0.8661 High Similarity NPC471826
0.8651 High Similarity NPC78446
0.8651 High Similarity NPC27671
0.8651 High Similarity NPC291899
0.8651 High Similarity NPC159132
0.8651 High Similarity NPC229113
0.8647 High Similarity NPC184861
0.8647 High Similarity NPC294456
0.8647 High Similarity NPC212124
0.8647 High Similarity NPC225106
0.8647 High Similarity NPC281014
0.8647 High Similarity NPC131198
0.8644 High Similarity NPC141068
0.864 High Similarity NPC100099
0.864 High Similarity NPC36016
0.8629 High Similarity NPC235190
0.8629 High Similarity NPC180006
0.8626 High Similarity NPC277021
0.8615 High Similarity NPC267336
0.8615 High Similarity NPC37009
0.8615 High Similarity NPC272650
0.8615 High Similarity NPC73738
0.8615 High Similarity NPC29734
0.8615 High Similarity NPC66430
0.8613 High Similarity NPC226722
0.8613 High Similarity NPC101255
0.8613 High Similarity NPC43716
0.8613 High Similarity NPC475719
0.8613 High Similarity NPC295696
0.8613 High Similarity NPC71739
0.8605 High Similarity NPC168710
0.8593 High Similarity NPC254994
0.8583 High Similarity NPC471827
0.8583 High Similarity NPC471828
0.8583 High Similarity NPC103420
0.8583 High Similarity NPC278552
0.8583 High Similarity NPC232692
0.8583 High Similarity NPC102540
0.8583 High Similarity NPC207179
0.8583 High Similarity NPC17809
0.8583 High Similarity NPC285040
0.8583 High Similarity NPC188022
0.8583 High Similarity NPC202594
0.8583 High Similarity NPC167571
0.8582 High Similarity NPC332594
0.8582 High Similarity NPC148738
0.8582 High Similarity NPC73078
0.8582 High Similarity NPC319870
0.8582 High Similarity NPC221046
0.8582 High Similarity NPC279573
0.8582 High Similarity NPC327612
0.8571 High Similarity NPC188380
0.8571 High Similarity NPC224543
0.8571 High Similarity NPC78746
0.8571 High Similarity NPC26954
0.8571 High Similarity NPC38099
0.8561 High Similarity NPC253574
0.8561 High Similarity NPC274121
0.8561 High Similarity NPC213216
0.8561 High Similarity NPC50898
0.8561 High Similarity NPC92830
0.8561 High Similarity NPC78540
0.8561 High Similarity NPC98179
0.8561 High Similarity NPC62366
0.855 High Similarity NPC137949
0.855 High Similarity NPC469956
0.854 High Similarity NPC36181
0.854 High Similarity NPC36732
0.8527 High Similarity NPC472519
0.8527 High Similarity NPC199204
0.8525 High Similarity NPC85292
0.8525 High Similarity NPC229147
0.8525 High Similarity NPC54507
0.8516 High Similarity NPC50315
0.8516 High Similarity NPC230479
0.8516 High Similarity NPC276212
0.8516 High Similarity NPC283049
0.8516 High Similarity NPC471215
0.8516 High Similarity NPC234109
0.8516 High Similarity NPC188327
0.8516 High Similarity NPC262573
0.8516 High Similarity NPC26879
0.8507 High Similarity NPC232246
0.8507 High Similarity NPC153818
0.8504 High Similarity NPC197351
0.8504 High Similarity NPC246648
0.8504 High Similarity NPC106914
0.8504 High Similarity NPC134195
0.8504 High Similarity NPC86502
0.8496 Intermediate Similarity NPC248872
0.8496 Intermediate Similarity NPC234865
0.8496 Intermediate Similarity NPC33986
0.8496 Intermediate Similarity NPC172262
0.8489 Intermediate Similarity NPC154217
0.8485 Intermediate Similarity NPC142563
0.8485 Intermediate Similarity NPC1220
0.8485 Intermediate Similarity NPC469449
0.8485 Intermediate Similarity NPC2363
0.8485 Intermediate Similarity NPC469955
0.8485 Intermediate Similarity NPC185777
0.8485 Intermediate Similarity NPC83535
0.8485 Intermediate Similarity NPC469952
0.8485 Intermediate Similarity NPC205797
0.8485 Intermediate Similarity NPC141822
0.8485 Intermediate Similarity NPC291551
0.8485 Intermediate Similarity NPC472524
0.8485 Intermediate Similarity NPC241165
0.8478 Intermediate Similarity NPC87609
0.8478 Intermediate Similarity NPC196459
0.8478 Intermediate Similarity NPC470296
0.8478 Intermediate Similarity NPC94794
0.8478 Intermediate Similarity NPC188632
0.8478 Intermediate Similarity NPC112791
0.8478 Intermediate Similarity NPC86069
0.8473 Intermediate Similarity NPC137264
0.8462 Intermediate Similarity NPC197425
0.8462 Intermediate Similarity NPC134360

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC168259 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
0.9496 High Similarity NPD422 Phase 1
0.9 High Similarity NPD1548 Phase 1
0.871 High Similarity NPD1610 Phase 2
0.8667 High Similarity NPD3750 Approved
0.8651 High Similarity NPD3225 Approved
0.8485 Intermediate Similarity NPD5124 Phase 1
0.8485 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.8438 Intermediate Similarity NPD2797 Approved
0.8397 Intermediate Similarity NPD1296 Phase 2
0.8397 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.8385 Intermediate Similarity NPD4908 Phase 1
0.8385 Intermediate Similarity NPD1008 Clinical (unspecified phase)
0.8385 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.8309 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.8309 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.8308 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.8296 Intermediate Similarity NPD3748 Approved
0.8258 Intermediate Similarity NPD3268 Approved
0.8258 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.8248 Intermediate Similarity NPD1549 Phase 2
0.8197 Intermediate Similarity NPD5535 Approved
0.8188 Intermediate Similarity NPD1652 Phase 2
0.8162 Intermediate Similarity NPD1510 Phase 2
0.8154 Intermediate Similarity NPD1203 Approved
0.8134 Intermediate Similarity NPD1613 Approved
0.8134 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.8102 Intermediate Similarity NPD1551 Phase 2
0.8067 Intermediate Similarity NPD9697 Approved
0.8028 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.8015 Intermediate Similarity NPD3267 Approved
0.8015 Intermediate Similarity NPD3266 Approved
0.8 Intermediate Similarity NPD1240 Approved
0.7958 Intermediate Similarity NPD1511 Approved
0.791 Intermediate Similarity NPD4625 Phase 3
0.7902 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7899 Intermediate Similarity NPD4308 Phase 3
0.7883 Intermediate Similarity NPD1607 Approved
0.7872 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7863 Intermediate Similarity NPD4749 Approved
0.7862 Intermediate Similarity NPD1653 Approved
0.7857 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7847 Intermediate Similarity NPD1512 Approved
0.7846 Intermediate Similarity NPD1535 Discovery
0.7823 Intermediate Similarity NPD7411 Suspended
0.781 Intermediate Similarity NPD4340 Discontinued
0.7801 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.78 Intermediate Similarity NPD3749 Approved
0.7786 Intermediate Similarity NPD9717 Approved
0.7786 Intermediate Similarity NPD1481 Phase 2
0.777 Intermediate Similarity NPD7033 Discontinued
0.7733 Intermediate Similarity NPD7768 Phase 2
0.7714 Intermediate Similarity NPD2796 Approved
0.7708 Intermediate Similarity NPD6799 Approved
0.7682 Intermediate Similarity NPD7075 Discontinued
0.7676 Intermediate Similarity NPD1243 Approved
0.7671 Intermediate Similarity NPD5403 Approved
0.7667 Intermediate Similarity NPD940 Approved
0.7667 Intermediate Similarity NPD4288 Approved
0.7667 Intermediate Similarity NPD846 Approved
0.7655 Intermediate Similarity NPD5401 Approved
0.7652 Intermediate Similarity NPD1608 Approved
0.7651 Intermediate Similarity NPD6801 Discontinued
0.763 Intermediate Similarity NPD2861 Phase 2
0.7616 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7609 Intermediate Similarity NPD4307 Phase 2
0.7609 Intermediate Similarity NPD4060 Phase 1
0.76 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.76 Intermediate Similarity NPD7819 Suspended
0.76 Intermediate Similarity NPD1465 Phase 2
0.7591 Intermediate Similarity NPD2313 Discontinued
0.7591 Intermediate Similarity NPD6798 Discontinued
0.7586 Intermediate Similarity NPD7213 Phase 3
0.7586 Intermediate Similarity NPD7212 Phase 2
0.7584 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7566 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7561 Intermediate Similarity NPD968 Approved
0.7538 Intermediate Similarity NPD1894 Discontinued
0.7534 Intermediate Similarity NPD7447 Phase 1
0.7533 Intermediate Similarity NPD1934 Approved
0.7518 Intermediate Similarity NPD3027 Phase 3
0.7517 Intermediate Similarity NPD4380 Phase 2
0.7517 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7517 Intermediate Similarity NPD6599 Discontinued
0.75 Intermediate Similarity NPD3496 Discontinued
0.75 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7483 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7483 Intermediate Similarity NPD2801 Approved
0.7465 Intermediate Similarity NPD6100 Approved
0.7465 Intermediate Similarity NPD2935 Discontinued
0.7465 Intermediate Similarity NPD6099 Approved
0.7464 Intermediate Similarity NPD3764 Approved
0.7464 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.745 Intermediate Similarity NPD8158 Clinical (unspecified phase)
0.7445 Intermediate Similarity NPD6832 Phase 2
0.7444 Intermediate Similarity NPD1091 Approved
0.7444 Intermediate Similarity NPD1611 Approved
0.7438 Intermediate Similarity NPD1242 Phase 1
0.7434 Intermediate Similarity NPD3817 Phase 2
0.7434 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7432 Intermediate Similarity NPD920 Approved
0.7424 Intermediate Similarity NPD4626 Approved
0.7424 Intermediate Similarity NPD17 Approved
0.7415 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7394 Intermediate Similarity NPD2799 Discontinued
0.7391 Intermediate Similarity NPD7095 Approved
0.7389 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7379 Intermediate Similarity NPD4628 Phase 3
0.7368 Intermediate Similarity NPD3847 Discontinued
0.736 Intermediate Similarity NPD1358 Approved
0.732 Intermediate Similarity NPD5402 Approved
0.7308 Intermediate Similarity NPD6671 Approved
0.7305 Intermediate Similarity NPD6355 Discontinued
0.7297 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7293 Intermediate Similarity NPD1778 Approved
0.7286 Intermediate Similarity NPD6233 Phase 2
0.728 Intermediate Similarity NPD3134 Approved
0.7279 Intermediate Similarity NPD6667 Approved
0.7279 Intermediate Similarity NPD6666 Approved
0.7273 Intermediate Similarity NPD9545 Approved
0.725 Intermediate Similarity NPD5844 Phase 1
0.7222 Intermediate Similarity NPD290 Approved
0.7219 Intermediate Similarity NPD3226 Approved
0.7218 Intermediate Similarity NPD5691 Approved
0.7214 Intermediate Similarity NPD411 Approved
0.7206 Intermediate Similarity NPD6582 Phase 2
0.7206 Intermediate Similarity NPD6583 Phase 3
0.7203 Intermediate Similarity NPD4978 Clinical (unspecified phase)
0.7194 Intermediate Similarity NPD2614 Approved
0.7192 Intermediate Similarity NPD2800 Approved
0.7188 Intermediate Similarity NPD3818 Discontinued
0.7185 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7183 Intermediate Similarity NPD447 Suspended
0.7178 Intermediate Similarity NPD7549 Discontinued
0.7165 Intermediate Similarity NPD2684 Approved
0.7161 Intermediate Similarity NPD3882 Suspended
0.7154 Intermediate Similarity NPD1241 Discontinued
0.7152 Intermediate Similarity NPD6232 Discontinued
0.7143 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7133 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.7122 Intermediate Similarity NPD3018 Phase 2
0.7121 Intermediate Similarity NPD9493 Approved
0.7115 Intermediate Similarity NPD6971 Discontinued
0.7114 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7113 Intermediate Similarity NPD4140 Approved
0.7107 Intermediate Similarity NPD2859 Approved
0.7107 Intermediate Similarity NPD2860 Approved
0.7089 Intermediate Similarity NPD7199 Phase 2
0.7083 Intermediate Similarity NPD7097 Phase 1
0.708 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7077 Intermediate Similarity NPD7843 Approved
0.7073 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.707 Intermediate Similarity NPD919 Approved
0.7067 Intermediate Similarity NPD2533 Approved
0.7067 Intermediate Similarity NPD2532 Approved
0.7067 Intermediate Similarity NPD2534 Approved
0.7063 Intermediate Similarity NPD6166 Phase 2
0.7063 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7063 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7063 Intermediate Similarity NPD230 Phase 1
0.7063 Intermediate Similarity NPD1933 Approved
0.7063 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7055 Intermediate Similarity NPD2344 Approved
0.7055 Intermediate Similarity NPD2346 Discontinued
0.7055 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7055 Intermediate Similarity NPD5953 Discontinued
0.705 Intermediate Similarity NPD1019 Discontinued
0.705 Intermediate Similarity NPD2798 Approved
0.705 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.705 Intermediate Similarity NPD6584 Phase 3
0.7044 Intermediate Similarity NPD7229 Phase 3
0.7042 Intermediate Similarity NPD4062 Phase 3
0.7037 Intermediate Similarity NPD7286 Phase 2
0.7037 Intermediate Similarity NPD7054 Approved
0.7037 Intermediate Similarity NPD6516 Phase 2
0.7037 Intermediate Similarity NPD5846 Approved
0.7029 Intermediate Similarity NPD8651 Approved
0.7029 Intermediate Similarity NPD1283 Approved
0.7027 Intermediate Similarity NPD3892 Phase 2
0.7025 Intermediate Similarity NPD2934 Approved
0.7025 Intermediate Similarity NPD2933 Approved
0.7021 Intermediate Similarity NPD5163 Phase 2
0.7019 Intermediate Similarity NPD7473 Discontinued
0.7012 Intermediate Similarity NPD6559 Discontinued
0.7 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD7837 Clinical (unspecified phase)
0.6994 Remote Similarity NPD7074 Phase 3
0.6994 Remote Similarity NPD7472 Approved
0.6993 Remote Similarity NPD943 Approved
0.6993 Remote Similarity NPD5808 Clinical (unspecified phase)
0.6986 Remote Similarity NPD1537 Approved
0.6986 Remote Similarity NPD4477 Approved
0.6986 Remote Similarity NPD1519 Approved
0.6986 Remote Similarity NPD1538 Phase 1
0.6986 Remote Similarity NPD4476 Approved
0.6981 Remote Similarity NPD6959 Discontinued
0.6978 Remote Similarity NPD1164 Approved
0.6978 Remote Similarity NPD987 Approved
0.6977 Remote Similarity NPD4750 Phase 3
0.6977 Remote Similarity NPD5451 Approved
0.6974 Remote Similarity NPD6980 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   5398649
ChEMBL   CHEMBL600635
ZINC  

Physicochemical Properties

Molecular Weight:  254.06
ALogP:  -0.8462
MLogP:  2.67
XLogP:  3.799
# Rotatable Bonds:  3
Polar Surface Area:  66.76
# H-Bond Aceptor:  1
# H-Bond Donor:  2
# Rings:  3
# Heavy Atoms:  19

Download Data

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