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ChEMBL

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ChEMBL Statistics
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UniChem Connectivity Layer Cross References

Legend

Letters 's', 'i' and 'p' describe how structures differ from structure with InChI Key FNYZFZRGBBCWBI-UHFFFAOYSA-L

  • s = stereochemical difference.
  • i = isotopic difference.
  • p = protonation differences identified.



Source Identical Component s i p si ip sp sip
ChEMBL CHEMBL1447476 CHEMBL290106
DrugBank DB04813
PDBe B1T NA
Guide to Pharmacology 2338
KEGG Ligand C07967 C01330
ChEBI 3131 29101
ZINC ZINC000000608213
eMolecules 3715264 510833 519280
IBM Patent System 2D86B2FB1D94BE1EAB8584921067815D
FDA SRS 66V0139H9A AMT77LS62O LYR4M0NH37 18HB6B1L37 UR0T0B24E9
SureChEMBL SCHEMBL636173 SCHEMBL2718915 SCHEMBL4349104 SCHEMBL5142871 SCHEMBL10392807 SCHEMBL9446445 SCHEMBL64385 SCHEMBL1158099 SCHEMBL8332867 SCHEMBL636174 SCHEMBL4179511 SCHEMBL15864671 SCHEMBL3777043 SCHEMBL636174 SCHEMBL157767 SCHEMBL1158099 SCHEMBL8333713 SCHEMBL27657
Human Metabolome Database HMDB0000588
PubChem: Thomson Pharma 14928183 15472383 15119549
PubChem 22882 57464677 2406 66925419 87427449 87785982 70357897 88464553 2407 192115 90272861 60148380 6453501 88280583 68782089 20975310 87630935 131880926 21566565 60148380 57464677 21863552 66925419 21566565 20429074 923 22461840 71587009 71587008 21566565
Mcule MCULE-6591279983 MCULE-3833394421
NMRShiftDB 20200589
LINCS LSM-2862
ACToR 6385-58-6 77482-46-3 97-18-7 57484-86-3 17341-25-2
Recon na1
MolPort MolPort-003-702-306 MolPort-046-069-029
Nikkaji J8.404B J4.438E J1.085.483K
BindingDB 36880
EPA CompTox Dashboard DTXSID8021270 DTXSID9021342 DTXSID50228191 DTXSID8037671 DTXSID10168327 DTXSID70168328
DrugCentral 3032
Metabolights MTBLC29101
Brenda 208282 202694 1602 48043 208284 202693 208283 48042 208285 135834 2375 202160 59
Rhea 29101

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/key_search/FNYZFZRGBBCWBI-UHFFFAOYSA-L/0/0/4
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