Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | GFER | P55789 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL6111989 | 0.88 | THRB (0.32) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL5403021 | 0.82 | KDM4E (0.39) | ALDH1A1SMN1; SMN2KMT2AMEN1HPGD | |
| SCHEMBL5403025 | 0.82 | KDM4E (0.39) | ALDH1A1SMN1; SMN2KMT2AMEN1HPGD | |
| SCHEMBL6103454 | 0.81 | ALDH1A1 (0.33) | ALDH1A1KMT2AMEN1GAAHPGD | |
| SCHEMBL5731426 | 0.80 | ALOX5 (0.34) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL5731703 | 0.80 | KCNB1 (0.34) | SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL5728218 | 0.80 | CUL4A (0.33) | SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL6111059 | 0.79 | KMT2A (0.32) | ALDH1A1KMT2A | |
| SCHEMBL5446807 | 0.78 | ABCC1 (0.34) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL5446806 | 0.78 | ABCC1 (0.34) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA |
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-1694665-A2 | SUBSTITUTED THIOPHENES | AiCuris GmbH & Co. KG (DE) | 2006-08-30 | — | — | EP | disclosed |
| WO-2006072348-A2 | ALKINYL-SUBSTITUTED THIOPHENES | AICURIS GMBH & CO. KG (DE) | 2006-07-13 | — | — | WO | disclosed |
| WO-2005063734-A2 | SUBSTITUTED THIOPHENES | AICURIS GMBH & CO. KG (DE) | 2005-07-14 | — | — | WO | disclosed |