Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | CCR8 | P51685 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.30 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.30 |
| ▸ | INCENP | Q9NQS7 | 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 | |
|---|---|---|---|---|
| SCHEMBL21241294 | 0.78 | DAO (0.46) | DAOCCR1CCR5CCR8HDAC6 | |
| SCHEMBL12314687 | 0.77 | DAO (0.40) | DAOCCR1CCR5CCR8HDAC6 | |
| SCHEMBL11353153 | 0.75 | UHRF1 (0.38) | CCR1CCR5CCR8NOS3NOS2 | |
| SCHEMBL19608193 | 0.74 | CCR1 (0.44) | DAOCCR1CCR5CCR8HDAC6 | |
| SCHEMBL30918471 | 0.73 | — | — | |
| SCHEMBL286357 | 0.73 | — | — | |
| SCHEMBL5166417 | 0.71 | ALDH1A1 (0.51) | — | |
| Hydrochloric Acid SCHEMBL126755 | 0.71 | CCR1 (0.46) | DAOCCR1CCR5CCR8HDAC6 | |
| Hydrochloric Acid SCHEMBL28024971 | 0.71 | CCR1 (0.46) | DAOCCR1CCR5CCR8HDAC6 | |
| SCHEMBL20072398 | 0.71 | CCR1 (0.46) | DAOCCR1CCR5CCR8HDAC6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4272534-A | 2-(Pyrid-2-yl)tetrahydrothiophene derivatives | RHONE-POULENC INDUSTRIES (FR) | 1981-06-09 | — | — | US | disclosed |