Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CES1 | P23141 | 6/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 5/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | KDM5A | P29375 | 2/20 | 0.30 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.30 |
| ▸ | SCD | O00767 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL103667 | 0.74 | CA12 (0.40) | CA12CA1CA9CES1ALDH1A1 | |
| SCHEMBL8152422 | 0.70 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL21253134 | 0.65 | — | — | |
| SCHEMBL497913 | 0.64 | CA12 (0.58) | CA12CA1CA9CES1ALDH1A1 | |
| SCHEMBL2123995 | 0.64 | CA12 (0.46) | CA12CA1CA9CES1ALDH1A1 | |
| SCHEMBL103877 | 0.63 | ALDH1A1 (0.40) | CA12CA1CA9CES1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3023639 | 0.62 | CA12 (0.56) | CA12CA1CA9CES1ALDH1A1 | |
| SCHEMBL11277722 | 0.62 | — | — | |
| SCHEMBL498121 | 0.62 | — | — | |
| Acetone SCHEMBL27904025 | 0.61 | CA12 (0.54) | CA12CA1CA9CES1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4855373-A | Multi-sited hydrazone initiators of vinyl polymerization | THE DOW CHEMICAL COMPANY (US) | 1989-08-08 | — | — | US | claimed |
| US-5218066-A | Hydrazone initiated polymerization process | THE DOW CHEMICAL COMPANY (US) | 1993-06-08 | — | — | US | disclosed |
| US-4855373-A | Multi-sited hydrazone initiators of vinyl polymerization | THE DOW CHEMICAL COMPANY (US) | 1989-08-08 | — | — | US | disclosed |