Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.45 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CTSD | P07339 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MME | P08473 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24185443 | 1.00 | CA12 (0.47) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL24185438 | 1.00 | CA12 (0.47) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL19292546 | 0.83 | BIRC2 (0.47) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL15359456 | 0.82 | CA12 (0.48) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL15359461 | 0.82 | CA12 (0.48) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL15055494 | 0.82 | CA12 (0.48) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL15222249 | 0.81 | CA12 (0.44) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL23135886 | 0.80 | CA12 (0.47) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL19425734 | 0.80 | CA12 (0.47) | CA12CA14BIRC2CA7CA9 | |
| SCHEMBL10219013 | 0.80 | CA12 (0.47) | CA12CA14BIRC2CA7CA9 |
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-113167695-A | Device for collecting volatile organic compounds | 法国由内政部代表 | 2021-07-23 | — | — | CN | disclosed |