Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHKA | P35790 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.49 |
| ▸ | HRH1 | P35367 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| N-Methylpiperidine SCHEMBL28957034 | 0.85 | TSHR (0.49) | CHKASMN1; SMN2TSHRKCNH2 | |
| N-Methylpiperidine SCHEMBL28303393 | 0.82 | APOBEC3A (0.38) | CHKAPOLBHRH1KCNH2 | |
| N-Methylpiperidine SCHEMBL28846661 | 0.79 | CA12 (0.50) | MAPT | |
| Toluene SCHEMBL1459338 | 0.78 | LMNA (0.55) | CHKATSHRPOLBHRH3HRH1 | |
| Iodobenzene SCHEMBL27797445 | 0.76 | SETD7 (0.42) | CHKAPOLBHRH1KCNH2 | |
| SCHEMBL30108226 | 0.76 | MELK (0.60) | CHKASMN1; SMN2NPC1MAPTRAB9A | |
| N-Methylpiperidine SCHEMBL3981520 | 0.76 | ALDH1A1 (0.47) | SMN1; SMN2TSHRPOLBNPC1MAPT | |
| Biphenyl SCHEMBL28611575 | 0.76 | ALDH1A1 (0.75) | NPC1MAPK1RAB9A | |
| Biphenyl SCHEMBL28699441 | 0.76 | ALDH1A1 (0.75) | NPC1MAPK1RAB9A | |
| Biphenyl SCHEMBL396019 | 0.76 | ALDH1A1 (0.75) | NPC1MAPK1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117364144-A | Bismuth-based catalyst and preparation method and application thereof | 华中科技大学 | 2024-01-09 | — | — | CN | disclosed |