Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.50 |
| ▸ | CCR3 | P51677 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3652328 | 1.00 | TACR1 (0.50) | TACR1CCR3CA1CA2CA4 | |
| SCHEMBL8925926 | 1.00 | TACR1 (0.50) | TACR1CCR3CA1CA2CA4 | |
| SCHEMBL18640258 | 0.92 | TACR1 (0.47) | TACR1 | |
| SCHEMBL18640306 | 0.87 | CHRNA7 (0.50) | TACR1 | |
| SCHEMBL14155625 | 0.86 | SIGMAR1 (0.45) | — | |
| SCHEMBL18640230 | 0.85 | TACR1 (0.48) | TACR1CCR3 | |
| SCHEMBL6994439 | 0.84 | SIGMAR1 (0.53) | CA1CA2CA4CA9 | |
| SCHEMBL18640284 | 0.84 | TACR1 (0.47) | TACR1 | |
| SCHEMBL6853109 | 0.83 | CCR3 (0.53) | CCR3 | |
| SCHEMBL18640277 | 0.83 | CYP2D6 (0.53) | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5646144-A | FOR TREATING DISORDERS IN WHICH SUBSTANCE P PLAYS A PART IN DEVELOPMENT | CIBA-GEIGY CORPORATION (US) | 1997-07-08 | — | — | US | disclosed |
| US-5541195-A | SUBSTANCE P ANTAGONISTS | CIBA-GEIGY CORPORATION (US) | 1996-07-30 | — | — | US | disclosed |
| EP-0532456-B1 | 1-Acylpiperidine derivatives and their use as substance P antagonists | CIBA GEIGY AG (CH) | 1995-03-29 | — | — | EP | disclosed |
| US-5310743-A | Substance P antagonist | CIBA-GEIGY CORP. (US) | 1994-05-10 | — | — | US | disclosed |
| EP-0532456-A1 | 1-Acylpiperidine derivatives and their use as substance P antagonists | CIBA-GEIGY AG (CH) | 1993-03-17 | — | — | EP | disclosed |