Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.48 |
| ▸ | KIF11 | P52732 | 10/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10797048 | 0.90 | GRIN2D (0.40) | — | |
| SCHEMBL10990329 | 0.87 | RIPK1 (0.40) | TAAR1KIF11RIPK1 | |
| SCHEMBL10996568 | 0.86 | PPARA (0.43) | KIF11MAPTKMT2A | |
| SCHEMBL10411897 | 0.84 | SHBG (0.48) | TAAR1KIF11SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10708609 | 0.84 | CNR2 (0.44) | MAPT | |
| SCHEMBL7642061 | 0.82 | OPRM1 (0.38) | — | |
| SCHEMBL10801277 | 0.82 | ESR1 (0.38) | TAAR1SLC6A2SLC6A4 | |
| SCHEMBL10970893 | 0.82 | ESR1 (0.38) | TAAR1SLC6A2SLC6A4KMT2A | |
| SCHEMBL10923682 | 0.82 | KIF11 (0.40) | TAAR1KIF11SLC6A2MAOASLC6A4 | |
| SCHEMBL11001270 | 0.82 | CYP2D6 (0.40) | KIF11CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4554379-A | POLYAMIDES, DRUGS | CIBA GEIGY CORPORATION (US) | 1985-11-19 | — | — | US | disclosed |
| EP-0069063-A1 | Aminoalkyl-substituted aromatic or heterocyclic compounds and process for their preparation | CIBA-GEIGY AG (CH) | 1983-01-05 | — | — | EP | disclosed |