Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.53 |
| ▸ | CA2 | P00918 | 3/20 | 0.53 |
| ▸ | CA9 | Q16790 | 3/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 3/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2538708 | 0.93 | CA12 (0.53) | CA12CA2CA9CA1CHRNB4 | |
| Hydrochloric Acid SCHEMBL27935953 | 0.91 | CA12 (0.52) | CA12CA2CA9CA1CHRNB4 | |
| Formic Acid SCHEMBL28858365 | 0.85 | CA12 (0.49) | CA12CA2CA9CA1CHRNB4 | |
| SCHEMBL15880928 | 0.81 | CA12 (0.49) | CA12CA2CA9CA1CHRNB4 | |
| SCHEMBL27578424 | 0.79 | CA12 (0.47) | CA12CA2CA9CA1CHRNB4 | |
| SCHEMBL9372692 | 0.79 | — | — | |
| SCHEMBL1765644 | 0.78 | CA12 (0.46) | CA12CA2CA9CA1CHRNB4 | |
| SCHEMBL3033994 | 0.78 | CA12 (0.46) | CA12CA2CA9CA1CHRNB4 | |
| SCHEMBL29371342 | 0.78 | CA12 (0.46) | CA12CA2CA9CA1CHRNB4 | |
| Ethoxycarbonyl Group SCHEMBL27606195 | 0.78 | CA12 (0.42) | CA12CA2CA9CA1CHRNB4 |
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-115087440-A | TRPML modulators | 卡斯玛治疗公司 | 2022-09-20 | — | — | CN | disclosed |