Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | ADK | P55263 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6037395 | 0.79 | KMT2A (0.47) | TAAR1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL6432858 | 0.78 | KMT2A (0.46) | TAAR1KMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL2125830 | 0.76 | CA12 (0.45) | TAAR1KMT2ACYP2D6TSHRMTOR | |
| SCHEMBL6037444 | 0.74 | KMT2A (0.46) | TAAR1KMT2ASMN1; SMN2GAAKDM4E | |
| SCHEMBL8429837 | 0.71 | TAAR1 (0.46) | TAAR1KMT2ACYP2D6TSHRMTOR | |
| SCHEMBL4765851 | 0.71 | — | — | |
| SCHEMBL7952741 | 0.69 | TAAR1 (0.38) | TAAR1KMT2AMTORADKNISCH | |
| SCHEMBL11625007 | 0.69 | TAAR1 (0.55) | TAAR1KMT2ACYP2D6TSHRMTOR | |
| SCHEMBL432658 | 0.69 | TDP1 (0.53) | TAAR1KMT2ATSHRLMNARAB9A | |
| SCHEMBL19062556 | 0.69 | ALDH1A1 (0.55) | KMT2AADORA2AGAAALDH1A1 |
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-4389409-A | 1-(α-n-Butylthio-2,4-dichlorophenethyl)imidazol-3-yl and fungicidal use thereof | ROHM AND HAAS COMPANY (US) | 1983-06-21 | — | — | US | disclosed |