Formic Acid

Formic Acid

SCHEMBL31017342

O=CO.[2H]C([2H])([2H])NC(=O)c1ccc(Cl)nn1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JUN P05412 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
POLB P06746 1/20 0.34
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SCN10A Q9Y5Y9 1/20 0.30
GAA P10253 2/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL29988880 0.94 NFKB1 (0.48) JUNNFKB1NFKB2RELAPOLB
Formic Acid SCHEMBL30465837 0.89 NFKB1 (0.47) JUNNFKB1NFKB2RELAPOLB
Trifluoroacetic Acid SCHEMBL30498406 0.84 JUN (0.50) JUNNFKB1NFKB2RELAPOLB
SCHEMBL667384 0.81 NFKB1 (0.51) JUNNFKB1NFKB2RELAPOLB
Formic Acid SCHEMBL29166004 0.73 GAA (0.42) JUNNFKB1NFKB2RELAPOLB
SCHEMBL31306809 0.71 P2RX7 (0.52) JUNNFKB1NFKB2RELAPOLB
SCHEMBL8600253 0.71 P2RX7 (0.52) JUNNFKB1NFKB2RELAPOLB
SCHEMBL6983154 0.70 JUN (0.48) JUNNFKB1NFKB2RELAPOLB
SCHEMBL4155438 0.70 JUN (0.48) JUNNFKB1NFKB2RELAPOLB
SCHEMBL6418676 0.70 JUN (0.51) JUNNFKB1NFKB2RELAPOLB

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
CN-118401516-A TYK2 inhibitors, compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-26 CN disclosed