Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 17/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8078188 | 1.00 | TACR1 (0.55) | TACR1NPC1MTORRAB9A | |
| SCHEMBL6604556 | 1.00 | TACR1 (0.55) | TACR1NPC1MTORRAB9A | |
| SCHEMBL13875665 | 1.00 | TACR1 (0.55) | TACR1NPC1MTORRAB9A | |
| SCHEMBL472020 | 1.00 | TACR1 (0.55) | TACR1NPC1MTORRAB9A | |
| SCHEMBL14364969 | 1.00 | TACR1 (0.55) | TACR1NPC1MTORRAB9A | |
| SCHEMBL6135633 | 1.00 | TACR1 (0.55) | TACR1NPC1MTORRAB9A | |
| SCHEMBL6135412 | 1.00 | TACR1 (0.55) | TACR1NPC1MTORRAB9A | |
| SCHEMBL7121023 | 0.90 | TACR1 (0.49) | TACR1NPC1MTORRAB9A | |
| SCHEMBL9537788 | 0.87 | TACR1 (0.46) | TACR1 | |
| SCHEMBL9532928 | 0.87 | TACR1 (0.46) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0665844-A1 | SUBSTITUTED BENZYLAMINOQUINUCLIDINES AS SUBSTANCE P ANTAGONISTS | PFIZER INC. (US) | 1995-08-09 | — | — | EP | disclosed |
| WO-1994008997-A1 | SUBSTITUTED BENZYLAMINOQUINUCLIDINES AS SUBSTANCE P ANTAGONISTS | PFIZER INC. (US) | 1994-04-28 | — | — | WO | disclosed |