Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.47 |
| ▸ | CA1 | P00915 | 5/20 | 0.47 |
| ▸ | CA2 | P00918 | 5/20 | 0.47 |
| ▸ | CA9 | Q16790 | 5/20 | 0.47 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.35 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9209555 | 0.97 | CA12 (0.46) | CA12CA1CA2CA9MGLL | |
| SCHEMBL1902074 | 0.89 | ALDH1A1 (0.42) | CA12CA1CA2CA9MGLL | |
| SCHEMBL15173121 | 0.87 | CA12 (0.52) | CA12CA1CA2CA9MGLL | |
| SCHEMBL8772643 | 0.86 | ALDH1A1 (0.42) | CA12CA1CA2CA9MGLL | |
| Hydrochloric Acid SCHEMBL9523836 | 0.84 | CA12 (0.46) | CA12CA1CA2CA9MGLL | |
| SCHEMBL9873801 | 0.81 | ALDH1A1 (0.48) | CA12CA1CA2CA9MGLL | |
| SCHEMBL6687736 | 0.80 | CA12 (0.53) | CA12CA1CA2CA9MGLL | |
| SCHEMBL965514 | 0.79 | ALDH1A1 (0.50) | CA12CA1CA2CA9MGLL | |
| SCHEMBL17764216 | 0.78 | CA12 (0.41) | CA12CA1CA2CA9HCAR2 | |
| SCHEMBL9204812 | 0.78 | CA1 (0.44) | CA12CA1CA2CA9NAAA |
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 3 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 |