Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.42 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | CALM1 | P0DP23 | 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 | |
|---|---|---|---|---|
| SCHEMBL11236089 | 0.75 | TAAR1 (0.44) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| SCHEMBL9453231 | 0.75 | TAAR1 (0.44) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| SCHEMBL17529701 | 0.75 | TAAR1 (0.44) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| SCHEMBL706086 | 0.75 | TAAR1 (0.44) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| SCHEMBL15285895 | 0.71 | TAAR1 (0.41) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| Bromide SCHEMBL6698343 | 0.71 | TAAR1 (0.41) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| SCHEMBL10308668 | 0.71 | TAAR1 (0.46) | TAAR1SIGMAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL15285550 | 0.71 | TAAR1 (0.41) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| SCHEMBL15656642 | 0.70 | TAAR1 (0.44) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 | |
| Bromide SCHEMBL6698393 | 0.70 | TAAR1 (0.40) | TAAR1SIGMAR1SLC18A2TRPA1SLC6A2 |
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-116444563-A | Novel method for synthesizing triphosphine ligand | 广东欧凯新材料有限公司 | 2023-07-18 | — | — | CN | disclosed |