Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
| ▸ | ADH1B | P00325 | 1/20 | 0.30 |
| ▸ | ADH1C | P00326 | 1/20 | 0.30 |
| ▸ | ADH1A | P07327 | 1/20 | 0.30 |
| ▸ | ADH7 | P40394 | 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 | |
|---|---|---|---|---|
| SCHEMBL6698688 | 0.86 | — | — | |
| SCHEMBL3637414 | 0.77 | CYP3A4 (0.38) | — | |
| SCHEMBL570532 | 0.77 | TSHR (0.30) | TSHR | |
| SCHEMBL1783185 | 0.77 | TRPV1 (0.32) | TSHR | |
| SCHEMBL3678156 | 0.77 | CYP3A4 (0.33) | — | |
| SCHEMBL1783182 | 0.77 | TRPV1 (0.32) | TSHR | |
| SCHEMBL14878392 | 0.75 | — | — | |
| SCHEMBL28057877 | 0.74 | TSHR (0.35) | TSHRFDPSADH1BADH1CADH1A | |
| SCHEMBL8624273 | 0.74 | ADH1B (0.36) | TSHRFDPSADH1BADH1CADH1A | |
| SCHEMBL28492539 | 0.74 | LMNA (0.39) | TSHRFDPS |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0589965-B1 | ORGANOBORON REAGENTS FOR THE PREPARATION OF UNSUBSTITUTED PROPARGYLIC ALCOHOLS | MERRELL PHARMA INC (US) | 1997-01-08 | — | — | EP | disclosed |
| EP-0589965-A1 | NEW ORGANOBORON REAGENTS FOR THE PREPARATION OF UNSUBSTITUTED PROPARGYLIC ALCOHOLS. | MERRELL DOW PHARMA (US) | 1994-04-06 | — | — | EP | disclosed |
| WO-1993000347-A1 | NEW ORGANOBORON REAGENTS FOR THE PREPARATION OF UNSUBSTITUTED PROPARGYLIC ALCOHOLS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-01-07 | — | — | WO | disclosed |
| US-5157167-A | Organoboron reagents for the preparation of unsubstituted propargylic alcohols | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-10-20 | — | — | US | disclosed |
| US-5110966-A | New organoboron reagents for the preparation unsubstituted propargylic alcohols | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-05-05 | — | — | US | disclosed |