Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7364139 | 0.79 | TSHR (0.32) | TSHR | |
| SCHEMBL7348088 | 0.67 | CCR5 (0.30) | — | |
| SCHEMBL7359971 | 0.66 | — | — | |
| SCHEMBL7357562 | 0.66 | TSHR (0.31) | TSHR | |
| SCHEMBL2810221 | 0.64 | PGK1 (0.44) | — | |
| SCHEMBL531025 | 0.64 | RAPGEF4 (0.46) | TSHRKDM4E | |
| SCHEMBL893283 | 0.64 | ALDH1A1 (0.41) | TSHRALDH1A1 | |
| SCHEMBL317223 | 0.64 | TSHR (0.33) | TSHR | |
| SCHEMBL4759036 | 0.64 | TSHR (0.33) | TSHR | |
| SCHEMBL21472699 | 0.62 | RAPGEF4 (0.40) | TSHRALDH1A1 |
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-0805681-A4 | TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1998-05-06 | — | — | EP | disclosed |
| EP-0805681-A1 | TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1997-11-12 | — | — | EP | disclosed |
| WO-1996022775-A1 | TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1996-08-01 | — | — | WO | disclosed |