Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL8304091 | 0.93 | KAT6A (0.39) | PARP1CES2CES1HDAC1HDAC6 | |
| Fumaric Acid SCHEMBL8304095 | 0.93 | KAT6A (0.39) | PARP1CES2CES1HDAC1HDAC6 | |
| SCHEMBL10909763 | 0.84 | RECQL (0.49) | CYP2D6CYP2C9CYP2C19MEN1KMT2A | |
| Bromide SCHEMBL10365710 | 0.82 | RECQL (0.48) | CYP2D6CYP2C9CYP2C19MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10366206 | 0.82 | RECQL (0.48) | CYP2D6CYP2C9CYP2C19MEN1KMT2A | |
| SCHEMBL8303462 | 0.76 | CES2 (0.38) | CES2CES1GAAKAT6AMEN1 | |
| Bromide SCHEMBL8305746 | 0.75 | CES2 (0.37) | CES2CES1GAAKAT6AMEN1 | |
| Bromide SCHEMBL10365922 | 0.75 | CES2 (0.37) | CES2CES1GAAKAT6AMEN1 | |
| Bromide SCHEMBL8305743 | 0.75 | CES2 (0.37) | CES2CES1GAAKAT6AMEN1 | |
| SCHEMBL8304094 | 0.75 | PARP1 (0.35) | PARP1CES2CES1HDAC1HDAC6 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0582182-B1 | 1-Aminoacetamidopyrroles and 1-amino-2-(substituted) pyrroles and their use for the treatment of neurodegenerative dysfunctions | HOECHST MARION ROUSSEL INC (US) | 1999-10-20 | — | — | EP | claimed |