Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 8/20 | 0.68 |
| ▸ | HTR1B | P28222 | 2/20 | 0.64 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.61 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.61 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.54 |
| ▸ | HTR1D | P28221 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL13181430 | 0.81 | NISCH (1.00) | NISCHLMNAMAOBACHE | |
| SCHEMBL21672909 | 0.81 | NISCH (0.72) | NISCHLMNAMAOBACHE | |
| SCHEMBL9189709 | 0.80 | NISCH (0.85) | NISCHTSHRMAOBACHE | |
| SCHEMBL14340604 | 0.78 | HTR1B (0.68) | NISCHHTR1BTAAR1CYP2D6LMNA | |
| SCHEMBL5827600 | 0.78 | HTR1B (0.68) | NISCHHTR1BTAAR1CYP2D6LMNA | |
| Tolazoline SCHEMBL34961 | 0.77 | TAAR1 (1.00) | NISCHHTR1BTAAR1CYP2D6LMNA | |
| SCHEMBL11130963 | 0.75 | NISCH (0.64) | NISCHADRA2AADRA2BADRA2CADRA1D | |
| Tolazoline SCHEMBL34869 | 0.75 | TAAR1 (1.00) | NISCHHTR1BTAAR1CYP2D6LMNA | |
| Tolazoline SCHEMBL5053858 | 0.75 | TAAR1 (1.00) | NISCHHTR1BTAAR1CYP2D6LMNA | |
| Tolazoline SCHEMBL28254903 | 0.75 | TAAR1 (0.96) | NISCHHTR1BTAAR1CYP2D6LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4423204-A | HEAT RESISTANCE MOLDING MATERIALS | THE UPJOHN COMPANY (US) | 1983-12-27 | — | — | US | disclosed |