Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA4 | P22748 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | DAO | P14920 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL226184 | 0.83 | CYP1A2 (0.56) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL21269593 | 0.80 | CYP1A2 (0.54) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL21269337 | 0.80 | CYP1A2 (0.54) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL21269074 | 0.80 | CYP1A2 (0.54) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL4896485 | 0.78 | CES2 (0.54) | CES1CA2CA4TSHRCES2 | |
| SCHEMBL1508202 | 0.76 | CES1 (0.56) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL1666976 | 0.76 | CES1 (0.61) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL15519395 | 0.76 | CES1 (0.56) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL7196195 | 0.76 | CES1 (0.50) | CES1CA2CA4CYP1A2TSHR | |
| SCHEMBL1079930 | 0.74 | CES1 (0.54) | CES1CA2CA4CYP1A2TSHR |
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-5989527-A | Compositions and methods for improving the performance of chemical exfoliating agents, sunless tanning agents, skin lightening agents and insect repellents | INOLEX INVESTMENT CORPORATION (US) | 1999-11-23 | — | — | US | disclosed |