Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | USP2 | O75604 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | PRSS1 | P07477 | 8/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11223687 | 0.88 | GAA (0.47) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL11234372 | 0.85 | GAA (0.58) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL8516397 | 0.84 | GAA (0.58) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL11218926 | 0.82 | GAA (0.71) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL11224150 | 0.80 | GAA (0.69) | GAAALDH1A1KDM4EMAPTUSP2 | |
| Hydrochloric Acid SCHEMBL11233537 | 0.80 | GAA (0.75) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL11225049 | 0.80 | GAA (0.69) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL11217075 | 0.80 | GAA (0.69) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL11221321 | 0.80 | GAA (0.69) | GAAALDH1A1KDM4EMAPTUSP2 | |
| SCHEMBL11226585 | 0.80 | GAA (0.69) | GAAALDH1A1KDM4EMAPTUSP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0011844-B1 | COUPLING COMPONENTS FOR OXIDIZING HAIR DYES, THEIR PREPARATION AND HAIR DYES CONTAINING THEM | Henkel Kommanditgesellschaft auf Aktien (DE) | 1982-05-26 | — | — | EP | disclosed |
| US-4314809-A | BIS/2,4-DIAMINOPHENOXY/ALKANES | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1982-02-09 | — | — | US | disclosed |
| EP-0011844-A1 | Coupling components for oxidizing hair dyes, their preparation and hair dyes containing them | Henkel Kommanditgesellschaft auf Aktien (DE) | 1980-06-11 | — | — | EP | disclosed |