Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.33 |
| ▸ | S100A4 | P26447 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4456705 | 0.87 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRCYP3A4RECQL | |
| SCHEMBL22898043 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TDP1TSHRCYP3A4RECQL | |
| SCHEMBL29559430 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TDP1TSHRCYP3A4RECQL | |
| SCHEMBL14269307 | 0.79 | ALDH1A1 (0.58) | ALDH1A1TDP1TSHRCYP3A4RECQL | |
| SCHEMBL30842645 | 0.79 | ALDH1A1 (0.58) | ALDH1A1TDP1TSHRCYP3A4RECQL | |
| SCHEMBL8439887 | 0.79 | S100A4 (0.43) | ALDH1A1TDP1TSHRCYP3A4S100A4 | |
| SCHEMBL25234798 | 0.79 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRCYP3A4POLB | |
| SCHEMBL16400809 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TDP1TSHRCYP3A4POLB | |
| SCHEMBL2056645 | 0.76 | TSHR (0.55) | ALDH1A1TDP1TSHRCYP3A4RECQL | |
| SCHEMBL31729335 | 0.75 | TDP1 (0.64) | ALDH1A1TDP1TSHRPOLBKAT2B |
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-0863739-A2 | HAIR DYE | Wella Aktiengesellschaft (DE) | 1998-09-16 | — | — | EP | disclosed |
| WO-1998011863-A2 | HAIR DYE | WELLA AKTIENGESELLSCHAFT (DE) | 1998-03-26 | — | — | WO | disclosed |