Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 11/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL354119 | 0.84 | CAPN1 (0.43) | CA1CA7CA2CTSKCTSS | |
| SCHEMBL18662379 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL18675297 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL26984346 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL18662377 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL31444361 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL31547634 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL17282827 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL31638122 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 | |
| SCHEMBL27128245 | 0.80 | CA1 (0.42) | CA1CA7CA2CTSKCYP2D6 |
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-106661084-B | Macrocyclic broad spectrum antibiotics | 阿奇克斯制药公司 | 2021-08-31 | — | — | CN | disclosed |