Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR3 | P51677 | 7/20 | 0.55 |
| ▸ | TACR1 | P25103 | 11/20 | 0.50 |
| ▸ | CCR2 | P41597 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7932641 | 0.93 | CCR3 (0.57) | CCR3TACR1CCR2 | |
| SCHEMBL7925814 | 0.91 | CCR3 (0.50) | CCR3TACR1CYP2D6 | |
| SCHEMBL7938489 | 0.88 | CCR3 (0.59) | CCR3TACR1CYP2D6 | |
| SCHEMBL16226687 | 0.85 | TACR1 (0.52) | CCR3TACR1 | |
| SCHEMBL7987228 | 0.82 | CCR3 (0.67) | CCR3TACR1CCR2 | |
| SCHEMBL7938403 | 0.82 | CCR3 (0.59) | CCR3TACR1CYP2D6 | |
| SCHEMBL7926034 | 0.80 | TACR1 (0.48) | CCR3TACR1 | |
| SCHEMBL7934653 | 0.79 | CCR3 (0.60) | CCR3TACR1 | |
| SCHEMBL6479126 | 0.79 | TACR1 (0.54) | CCR3TACR1CCR2 | |
| SCHEMBL8674953 | 0.78 | TACR1 (0.45) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6191135-B1 | Neurokinin antagonists | BOEHRINGER INGELHEIM KG (DE) | 2001-02-20 | — | — | US | claimed |
| US-6191135-B1 | Neurokinin antagonists | BOEHRINGER INGELHEIM KG (DE) | 2001-02-20 | — | — | US | disclosed |
| WO-1996008480-A1 | NEUROKININ ANTAGONISTS | BOEHRINGER INGELHEIM KG (DE) | 1996-03-21 | — | — | WO | disclosed |