Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | ALPI | P09923 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | XIAP | P98170 | 1/20 | 0.44 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11492702 | 0.72 | ALDH1A1 (0.69) | ALDH1A1TDP1CYP1A2GABRA1CYP3A4 | |
| SCHEMBL1081229 | 0.71 | ALDH1A1 (1.00) | ALDH1A1TDP1CYP1A2GABRA1CYP3A4 | |
| SCHEMBL1081228 | 0.71 | ALDH1A1 (1.00) | ALDH1A1TDP1CYP1A2GABRA1CYP3A4 | |
| Pyrrole SCHEMBL11495979 | 0.71 | ALDH1A1 (0.62) | ALDH1A1TDP1CYP1A2GABRA1CYP3A4 | |
| SCHEMBL3932992 | 0.70 | CYP11B1 (0.56) | ALDH1A1TDP1PKMCYP11B1CYP11B2 | |
| SCHEMBL11730438 | 0.70 | ALDH1A1 (0.97) | ALDH1A1TDP1CYP1A2GABRA1CYP3A4 | |
| Hydrochloric Acid SCHEMBL28186334 | 0.69 | CYP11B1 (0.54) | ALDH1A1TDP1PKMCYP11B1CYP11B2 | |
| SCHEMBL9837208 | 0.69 | ALDH1A1 (0.65) | ALDH1A1TDP1CYP1A2GABRA1CYP3A4 | |
| SCHEMBL6050066 | 0.68 | GRN (0.46) | ALDH1A1TDP1PKMCYP11B1CYP11B2 | |
| SCHEMBL6801626 | 0.68 | ALDH1A1 (0.48) | ALDH1A1TDP1ALPIPKMPTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109206481-A | Peptide compound, application thereof and composition containing peptide compound | 凯惠科技发展(上海)有限公司 | 2019-01-15 | — | — | CN | disclosed |