Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 15/20 | 0.62 |
| ▸ | FABP7 | O15540 | 1/20 | 0.41 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8704248 | 1.00 | TACR1 (0.62) | TACR1FABP7FABP5KDM1A | |
| SCHEMBL8701134 | 0.83 | TACR1 (0.64) | TACR1FABP7FABP5 | |
| SCHEMBL8326932 | 0.83 | TACR1 (0.64) | TACR1FABP7FABP5 | |
| SCHEMBL8704699 | 0.81 | TACR1 (0.63) | TACR1FABP7FABP5 | |
| SCHEMBL8705585 | 0.81 | TACR1 (0.48) | TACR1 | |
| SCHEMBL8704702 | 0.81 | TACR1 (0.63) | TACR1FABP7FABP5 | |
| SCHEMBL8705581 | 0.81 | TACR1 (0.48) | TACR1 | |
| SCHEMBL8466576 | 0.79 | SLC18A3 (0.41) | TACR1 | |
| SCHEMBL21227466 | 0.78 | TACR1 (0.50) | TACR1 | |
| SCHEMBL17887707 | 0.78 | TACR1 (0.50) | TACR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0858444-A4 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1999-12-01 | — | — | EP | disclosed |
| EP-0858444-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1998-08-19 | — | — | EP | disclosed |
| US-5750549-A | ANTIINFLAMMATORY AGENTS OR ANALGESICS | MERCK & CO., INC. (US) | 1998-05-12 | — | — | US | disclosed |
| WO-1997014671-A1 | CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1997-04-24 | — | — | WO | disclosed |