Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | CETP | P11597 | 1/20 | 0.57 |
| ▸ | MMP1 | P03956 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | MMP2 | P08253 | 1/20 | 0.54 |
| ▸ | MMP9 | P14780 | 1/20 | 0.54 |
| ▸ | MMP12 | P39900 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | CNR1 | P21554 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 6/20 | 0.51 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.51 |
| ▸ | CCR8 | P51685 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2966035 | 0.95 | ALDH1A1 (0.66) | ALDH1A1CETPMMP1TDP1MMP2 | |
| SCHEMBL10417917 | 0.84 | CETP (0.56) | CETPMMP1TDP1MMP2MMP9 | |
| SCHEMBL29729966 | 0.84 | MMP1 (0.56) | ALDH1A1CETPMMP1TDP1MMP2 | |
| SCHEMBL28794034 | 0.82 | ALDH1A1 (0.69) | ALDH1A1TSHRFFAR1 | |
| SCHEMBL10795614 | 0.81 | MMP1 (0.54) | CETPMMP1TDP1MMP2MMP9 | |
| SCHEMBL10887508 | 0.81 | MMP1 (0.54) | ALDH1A1CETPMMP1TDP1MMP2 | |
| SCHEMBL8024062 | 0.81 | ALDH1A1 (0.72) | ALDH1A1MMP2FFAR1FFAR4 | |
| SCHEMBL22066497 | 0.81 | MMP1 (0.56) | CETPMMP1TDP1MMP2MMP9 | |
| SCHEMBL6667358 | 0.80 | MMP1 (0.59) | ALDH1A1CETPMMP1TDP1MMP2 | |
| SCHEMBL13034129 | 0.80 | ALDH1A1 (0.56) | ALDH1A1TDP1TSHRLMNAL3MBTL1 |
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-4709081-A | ETHERIFICATION, HYDROLYSIS | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) | 1987-11-24 | — | — | US | disclosed |