Formaldehyde

Formaldehyde

SCHEMBL9845728

C=O.CS(=O)(=O)O.[N-]=[N+]=C1C=CC=CC1Nc1ccccc1

nearest known ligand 0.33

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Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of Formaldehyde. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.33
BCAT2 O15382 1/20 0.32
MAPT P10636 1/20 0.32
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Formaldehyde SCHEMBL11317948 0.91 TSHR (0.40) KEAP1
Formaldehyde SCHEMBL11327926 0.84 ALDH1A1 (0.33) MAPT
SCHEMBL28333387 0.68 NFKB1 (0.37) NFKB1NFKB2RELA
SCHEMBL27405844 0.67 NFKB1 (0.34) MAPTNFKB1NFKB2RELA
SCHEMBL31514269 0.64 NFKB1 (0.38) NFKB1NFKB2RELA
SCHEMBL27633331 0.64 NFKB1 (0.38) NFKB1NFKB2RELA
SCHEMBL27405297 0.64 NFKB1 (0.38) NFKB1NFKB2RELA
SCHEMBL28833044 0.64 NFKB1 (0.34) NFKB1NFKB2RELA
SCHEMBL28392491 0.64 NFKB1 (0.35) NFKB1NFKB2RELA
Water SCHEMBL28875414 0.63 NFKB1 (0.37) NFKB1NFKB2RELA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415422-A2 Method for forming images FUJI PHOTO FILM CO., LTD. (JP) 1991-03-06 EP disclosed