Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10354380 | 0.88 | ALDH1A1 (0.41) | ALDH1A1POLBSMN1; SMN2KDM4EPLAU | |
| SCHEMBL28605251 | 0.87 | TSHR (0.43) | ALDH1A1POLBSMN1; SMN2KDM4EPLAU | |
| SCHEMBL30285317 | 0.85 | ALDH1A1 (0.55) | ALDH1A1POLBSMN1; SMN2KDM4EPLAU | |
| SCHEMBL805963 | 0.85 | ALDH1A1 (0.55) | ALDH1A1POLBSMN1; SMN2KDM4EPLAU | |
| SCHEMBL10349184 | 0.81 | ALDH1A1 (0.42) | ALDH1A1POLBSMN1; SMN2KDM4EPLAU | |
| SCHEMBL16247255 | 0.79 | ALDH1A1 (0.37) | ALDH1A1POLBSMN1; SMN2KDM4EPLAU | |
| SCHEMBL10695813 | 0.79 | ALDH1A1 (0.49) | ALDH1A1POLBSMN1; SMN2KDM4EPLAU | |
| SCHEMBL28014703 | 0.71 | ALDH1A1 (0.58) | ALDH1A1POLBSMN1; SMN2KDM4EHTT | |
| SCHEMBL31514804 | 0.70 | — | — | |
| SCHEMBL781371 | 0.70 | — | — |
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-4649201-A | SOLVENT EXTRACTION, ALKYLENE GLYCOL | THE DOW CHEMICAL COMPANY (US) | 1987-03-10 | — | — | US | claimed |
| US-4546192-A | Chlorine exchange for fluorine in ring-fluorinated pyridine compounds | THE DOW CHEMICAL COMPANY (US) | 1985-10-08 | — | — | US | claimed |
| US-4493932-A | Chlorine exchange for fluorine in 2-fluoro-pyridine compounds | THE DOW CHEMICAL COMPANY (US) | 1985-01-15 | — | — | US | claimed |