Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL335672 | 0.76 | KAT2B (0.47) | ALDH1A1KAT2BCYP1A2TSHRCTSD | |
| SCHEMBL4074230 | 0.75 | CYP1A2 (0.50) | ALDH1A1CYP1A2TSHRCTSDCYP3A4 | |
| SCHEMBL267829 | 0.72 | CYP1A2 (0.53) | ALDH1A1CYP1A2TSHRCTSDCYP3A4 | |
| SCHEMBL31145677 | 0.72 | CYP1A2 (0.53) | ALDH1A1CYP1A2TSHRCTSDCYP3A4 | |
| SCHEMBL12232402 | 0.72 | CYP1A2 (0.53) | ALDH1A1KAT2BCYP1A2TSHRCTSD | |
| SCHEMBL7153686 | 0.72 | CYP1A2 (0.53) | ALDH1A1KAT2BCYP1A2TSHRCTSD | |
| SCHEMBL2941917 | 0.70 | CYP1A2 (0.54) | ALDH1A1CYP1A2TSHRCTSDMEN1 | |
| SCHEMBL29834848 | 0.70 | CYP1A2 (0.54) | ALDH1A1CYP1A2TSHRCTSDMEN1 | |
| SCHEMBL9063259 | 0.70 | CYP1A2 (0.48) | ALDH1A1KAT2BCYP1A2TSHRCTSD | |
| SCHEMBL5142045 | 0.70 | CYP1A2 (0.48) | ALDH1A1CYP1A2TSHRCTSDCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4845293-A | HAIR DYE | L'OREAL (FR) | 1989-07-04 | — | — | US | disclosed |