PCIDB

KNApSAcK Metabolite C00000297

Metabolite

KNApSAcK Entry

id C00000297
Name Psoralen
CAS RN 66-97-7
Standard InChI InChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6H
Standard InChI (Main Layer) InChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6H

Cluster

Phytochemical cluster No. 25
KCF-S cluster No. 1282

Link

ChEMBL

By standard InChI CHEMBL164660
By standard InChI Main Layer CHEMBL164660

KEGG

By LinkDB C09305

CTD

By CAS RN D005363

Species

Summary

Plant class

class name count
rosids 72
asterids 6

Family

family name count
Fabaceae 48
Moraceae 16
Rutaceae 8
Apiaceae 6

List (78)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ammi majus 48026 Apiaceae asterids Viridiplantae
Arracacia xanthorrhiza 264540 Apiaceae asterids Viridiplantae
Bituminaria bituminosa 53836 Fabaceae rosids Viridiplantae
Coronilla coronata 237899 Fabaceae rosids Viridiplantae
Coronilla glauca 118894 Fabaceae rosids Viridiplantae
Coronilla juncea 390703 Fabaceae rosids Viridiplantae
Coronilla minima 181252 Fabaceae rosids Viridiplantae
Coronilla repanda 390704 Fabaceae rosids Viridiplantae
Coronilla scorpioides 118892 Fabaceae rosids Viridiplantae
Coronilla valentina 118893 Fabaceae rosids Viridiplantae
Coronilla viminalis 347984 Fabaceae rosids Viridiplantae
Cullen corylifolium 429560 Fabaceae rosids Viridiplantae
Cullen drupaceum 109218 Fabaceae rosids Viridiplantae
Cullen obtusifolium 109218 Fabaceae rosids Viridiplantae
Cullen plicatum 109218 Fabaceae rosids Viridiplantae
Dictamnus hispanicus 77005 Rutaceae rosids Viridiplantae
Dorstenia asaroides 319933 Moraceae rosids Viridiplantae
Dorstenia bahiensis 382339 Moraceae rosids Viridiplantae
Dorstenia barnimiana 106722 Moraceae rosids Viridiplantae
Dorstenia brasiliensis 984796 Moraceae rosids Viridiplantae
Dorstenia bryonifolia 106722 Moraceae rosids Viridiplantae
Dorstenia cayapiaa 106722 Moraceae rosids Viridiplantae
Dorstenia contrajerva 984801 Moraceae rosids Viridiplantae
Dorstenia drakena 984804 Moraceae rosids Viridiplantae
Dorstenia excentria 106722 Moraceae rosids Viridiplantae
Dorstenia heringerii 106722 Moraceae rosids Viridiplantae
Dorstenia lindeniana 984813 Moraceae rosids Viridiplantae
Dorstenia psilurus 106723 Moraceae rosids Viridiplantae
Dorstenia turbinata 984821 Moraceae rosids Viridiplantae
Fagara mayu 23513 Rutaceae rosids Viridiplantae
Feronia limonia 159053 Rutaceae rosids Viridiplantae
Ficus carica 3494 Moraceae rosids Viridiplantae
Ficus hirta 309429 Moraceae rosids Viridiplantae
Ficus sycomorus 182129 Moraceae rosids Viridiplantae
Haplophyllum patavinum 452780 Rutaceae rosids Viridiplantae
Heracleum levskovii 40917 Apiaceae asterids Viridiplantae
Hoita macrostachya 458335 Fabaceae rosids Viridiplantae
Orbexilum pedunculatum 458341 Fabaceae rosids Viridiplantae
Otholobium bolusii 1094751 Fabaceae rosids Viridiplantae
Otholobium candicans 53909 Fabaceae rosids Viridiplantae
Otholobium foliosum 53909 Fabaceae rosids Viridiplantae
Otholobium hirtum 53909 Fabaceae rosids Viridiplantae
Otholobium obliquum 53909 Fabaceae rosids Viridiplantae
Otholobium parviflorum 53909 Fabaceae rosids Viridiplantae
Otholobium sericeum 53910 Fabaceae rosids Viridiplantae
Otholobium stachyerum 53909 Fabaceae rosids Viridiplantae
Otholobium zeyheri 53909 Fabaceae rosids Viridiplantae
Pediomelum subacaule 458383 Fabaceae rosids Viridiplantae
Petroselinum crispum 4043 Apiaceae asterids Viridiplantae
Phebalium argenteum 77003 Rutaceae rosids Viridiplantae
Phebalium clavatum 282629 Rutaceae rosids Viridiplantae
Prionosciadium thapsoides 884312 Apiaceae asterids Viridiplantae
Psoralea affinis 100167 Fabaceae rosids Viridiplantae
Psoralea arborea 100167 Fabaceae rosids Viridiplantae
Psoralea cinerea 100168 Fabaceae rosids Viridiplantae
Psoralea corylifolia 429560 Fabaceae rosids Viridiplantae
Psoralea effusa 100167 Fabaceae rosids Viridiplantae
Psoralea exile 100167 Fabaceae rosids Viridiplantae
Psoralea fascicularis 100167 Fabaceae rosids Viridiplantae
Psoralea glabra 1237784 Fabaceae rosids Viridiplantae
Psoralea lachnostachys 100167 Fabaceae rosids Viridiplantae
Psoralea leucantha 100167 Fabaceae rosids Viridiplantae
Psoralea martinii 100167 Fabaceae rosids Viridiplantae
Psoralea oreopolum 100167 Fabaceae rosids Viridiplantae
Psoralea papillosa 100167 Fabaceae rosids Viridiplantae
Psoralea pinnata 760015 Fabaceae rosids Viridiplantae
Psoralea plumosa 100167 Fabaceae rosids Viridiplantae
Psoralea pullata 100167 Fabaceae rosids Viridiplantae
Psoralea pustulata 100167 Fabaceae rosids Viridiplantae
Psoralea ramulosa 100167 Fabaceae rosids Viridiplantae
Psoralea repens 100167 Fabaceae rosids Viridiplantae
Psoralea speciosa 100167 Fabaceae rosids Viridiplantae
Psoralea verrucosa 100167 Fabaceae rosids Viridiplantae
Ruta chalepensis L. 452790 Rutaceae rosids Viridiplantae
Saposhnikovia divaricata Schischkin 203716 Apiaceae asterids Viridiplantae
Securigera cretica 3803 Fabaceae rosids Viridiplantae
Securigera orientalis 181253 Fabaceae rosids Viridiplantae
Zanthoxylum flavum 1056471 Rutaceae rosids Viridiplantae

Human Protein / Gene in interaction

12 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P10635 Cytochrome P450 2D6 Cytochrome P450 2D6 CHEMBL164660 CHEMBL1614110 (1)
1 / 0
P20813 Cytochrome P450 2B6 Cytochrome P450 2B6 CHEMBL164660 CHEMBL1743495 (2)
1 / 0
P11712 Cytochrome P450 2C9 Cytochrome P450 2C9 CHEMBL164660 CHEMBL1614027 (1)
0 / 1
P11388 DNA topoisomerase 2-alpha Isomerase CHEMBL164660 CHEMBL1034330 (1)
0 / 0
P11509 Cytochrome P450 2A6 Cytochrome P450 2A6 CHEMBL164660 CHEMBL1743539 (2)
0 / 0
P83916 Chromobox protein homolog 1 Unclassified protein CHEMBL164660 CHEMBL1794401 (1)
0 / 0
P56817 Beta-secretase 1 A1A CHEMBL164660 CHEMBL1936881 (1) CHEMBL1936882 (1)
0 / 0
Q99714 3-hydroxyacyl-CoA dehydrogenase type-2 Enzyme CHEMBL164660 CHEMBL1613910 (1) CHEMBL1614227 (1)
3 / 3
P19838 Nuclear factor NF-kappa-B p105 subunit Transcription Factor CHEMBL164660 CHEMBL1291967 (1)
0 / 0
P33261 Cytochrome P450 2C19 Cytochrome P450 2C19 CHEMBL164660 CHEMBL1613777 (1)
1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL164660 CHEMBL1614108 (1) CHEMBL1613886 (1)
0 / 1
B2RXH2 Lysine-specific demethylase 4E Enzyme CHEMBL164660 CHEMBL1613914 (1)
0 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (6)

OMIM preferred title UniProt
#300438 17-beta-hydroxysteroid dehydrogenase x deficiency Q99714
#609535 Drug metabolism, poor, cyp2c19-related P33261
#608902 Drug metabolism, poor, cyp2d6-related P10635
#614546 Efavirenz, poor metabolism of P20813
#300705 Mental retardation, x-linked 17; mrx17 Q99714
#300220 Mental retardation, x-linked, syndromic 10; mrxs10 Q99714

KEGG DISEASE (6)

KEGG disease name UniProt
H00036 Osteosarcoma P08684 (marker)
H01205 Coumarin resistance P11712 (related)
H01171 Poor drug metabolism (PM) P33261 (related)
H00480 Non-syndromic X-linked mental retardation Q99714 (related)
H00658 Syndromic X-linked mental retardation Q99714 (related)
H00925 2-Methyl-3-hydroxybutyryl-CoA dehydrogenase (MHBD) deficiency Q99714 (related)

Diseases related to CTD interactions

5 disease from interactions of metabolites

MeSH disease OMIM compound disease name evidence type reference
pmid
D000647 D005363 Amnesia therapeutic
17318785
D002280 D005363 Carcinoma, Basal Cell marker/mechanism
11511317
D017484 D005363 Dermatitis, Phototoxic marker/mechanism
9361129
D056486 D005363 Drug-Induced Liver Injury marker/mechanism
22173200
D011565 D005363 Psoriasis therapeutic
14746632