Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SCN1A | P35498 | 2/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28144244 | 0.82 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4CHRM2 | |
| SCHEMBL28144242 | 0.82 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4CHRM2 | |
| SCHEMBL9995387 | 0.82 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4CHRM2 | |
| SCHEMBL5398515 | 0.82 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4CHRM2 | |
| SCHEMBL12071516 | 0.82 | CHRNB2 (0.56) | CHRNB2CHRNB4CHRNA3CHRNA4CHRM2 | |
| SCHEMBL27721341 | 0.81 | TRPA1 (0.49) | TRPA1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL17710458 | 0.80 | CHRNB2 (0.54) | CHRNB2CHRNB4CHRNA3CHRNA4SLC6A2 | |
| Bromide SCHEMBL28176004 | 0.80 | CHRNB2 (0.54) | CHRNB2CHRNB4CHRNA3CHRNA4CHRM2 | |
| SCHEMBL27659215 | 0.80 | RIPK1 (0.40) | TRPA1KDM4ELMNATSHRCYP2D6 | |
| SCHEMBL28854326 | 0.76 | SIGMAR1 (0.35) | CHRM2SLC6A2SLC6A4SCN1ASCN2A |
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-109694770-A | One Albatra metal cutting fluid composite and preparation method thereof | 上海樱花化研化工科技有限公司 | 2019-04-30 | — | — | CN | disclosed |