Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 5/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.33 |
| ▸ | DRD2 | P14416 | 5/20 | 0.33 |
| ▸ | DRD3 | P35462 | 5/20 | 0.33 |
| ▸ | HTR1A | P08908 | 4/20 | 0.33 |
| ▸ | HTR1B | P28222 | 4/20 | 0.33 |
| ▸ | DRD4 | P21917 | 4/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15720571 | 0.73 | LOXL2 (0.42) | CA1CA2HSD11B1HTR1DHTR1A | |
| SCHEMBL11945522 | 0.73 | CA1 (0.40) | CA1CA2HSD11B1HTR1DCHRM1 | |
| SCHEMBL17310149 | 0.73 | CA1 (0.40) | CA1CA2HSD11B1HTR1DCHRM1 | |
| SCHEMBL23674532 | 0.71 | CA1 (0.39) | CA1CA2HSD11B1HTR1DCHRM1 | |
| SCHEMBL28741515 | 0.70 | HTR1D (0.40) | CA1CA2HSD11B1HTR1DCHRM1 | |
| SCHEMBL28741615 | 0.70 | RIPK2 (0.41) | CA1CA2HSD11B1HTR1DCHRM1 | |
| SCHEMBL30384914 | 0.69 | PDE4A (0.41) | CA1CA2HSD11B1HTR1DCHRM1 | |
| SCHEMBL5308131 | 0.68 | CA2 (0.42) | CA1CA2HSD11B1HTR1DDRD2 | |
| SCHEMBL22836850 | 0.67 | CA2 (0.37) | CA1CA2HSD11B1HTR1DDRD2 | |
| SCHEMBL31032217 | 0.67 | KDM4C (0.50) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115916778-A | Methionine adenosyltransferase inhibitor, preparation method and application thereof | 赛诺哈勃药业（成都）有限公司 | 2023-04-04 | — | — | CN | disclosed |
| WO-2022053022-A1 | METHIONINE ADENOSYLTRANSFERASE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 赛诺哈勃药业（成都）有限公司 | 2022-03-17 | — | — | WO | disclosed |