Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 7/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SNCA | P37840 | 3/20 | 0.35 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | TNF | P01375 | 1/20 | 0.34 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.34 |
| ▸ | INSR | P06213 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL2028552 | 0.88 | SNCA (0.41) | ALDH1A1SMN1; SMN2MAPTPOLBRAB9A | |
| SCHEMBL7049507 | 0.84 | SMN1; SMN2 (0.45) | ALDH1A1KDM4EHPGDPKMSMN1; SMN2 | |
| SCHEMBL7049508 | 0.78 | APP (0.33) | ALDH1A1KDM4EHPGDPKMSMN1; SMN2 | |
| SCHEMBL3643981 | 0.76 | APP (0.42) | ALDH1A1KDM4EHPGDPKMSMN1; SMN2 | |
| SCHEMBL3214133 | 0.75 | APP (0.41) | ALDH1A1KDM4EHPGDPKMSMN1; SMN2 | |
| SCHEMBL4613852 | 0.75 | ALDH1A1 (0.61) | ALDH1A1KDM4EHPGDPKMSMN1; SMN2 | |
| SCHEMBL5382993 | 0.74 | SNCA (0.33) | POLBRAB9ASNCAAPPTNF | |
| SCHEMBL5067726 | 0.74 | APP (0.40) | ALDH1A1KDM4EHPGDPKMSMN1; SMN2 | |
| SCHEMBL2024739 | 0.73 | TRIM24 (0.41) | ALDH1A1POLBRAB9ASNCAAPP | |
| SCHEMBL9032592 | 0.73 | ALDH1A1 (0.55) | ALDH1A1KDM4EHPGDPKMSMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1300132-A2 | Agent for dyeing keratinous fibres | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-04-09 | — | — | EP | claimed |
| EP-1300132-A2 | Agent for dyeing keratinous fibres | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-04-09 | — | — | EP | disclosed |