Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 6/20 | 0.42 |
| ▸ | CA1 | P00915 | 6/20 | 0.42 |
| ▸ | CA9 | Q16790 | 6/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL8772643 | 0.81 | ALDH1A1 (0.42) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL1902074 | 0.81 | ALDH1A1 (0.42) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL244471 | 0.79 | ALDH1A1 (0.52) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL5161781 | 0.79 | EHMT2 (0.39) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL7031140 | 0.78 | CA12 (0.52) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL9209555 | 0.78 | CA12 (0.46) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL4336613 | 0.77 | ALDH1A1 (0.50) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL11516595 | 0.77 | ALDH1A1 (0.50) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL15486103 | 0.77 | ALDH1A1 (0.50) | ALDH1A1ALDH2CA12CA1CA9 | |
| SCHEMBL4382191 | 0.77 | ALDH1A1 (0.50) | ALDH1A1ALDH2CA12CA1CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0656415-B1 | Sulfurized aqueous machining fluid composition | CINCINNATI MILACRON INC (US) | 1997-10-08 | — | — | EP | disclosed |
| EP-0656415-A1 | Sulfurized aqueous machining fluid composition | CINCINNATI MILACRON INC. (US) | 1995-06-07 | — | — | EP | disclosed |
| US-5391310-A | Mixture of water and an organosulfur compound | CINCINNATI MILACRON INC. (US) | 1995-02-21 | — | — | US | disclosed |
| US-3976769-A | INSECTICIDE | AIRWICK INDUSTRIES, INC. (US) | 1976-08-24 | — | — | US | disclosed |