Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | DRD5 | P21918 | 1/20 | 0.31 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10909271 | 0.81 | CES1 (0.50) | CES1HTR2CALOX12HTR1AMEN1 | |
| SCHEMBL17147714 | 0.71 | HTR2C (0.46) | CES1HTR2CALOX12HTR1ANISCH | |
| SCHEMBL2846045 | 0.70 | HTR2C (0.49) | CES1HTR2CALOX12HTR1ANISCH | |
| SCHEMBL11536660 | 0.70 | HTR1A (0.48) | CES1HTR1AMEN1KMT2AHTT | |
| SCHEMBL10658365 | 0.69 | CES1 (0.51) | CES1HTR2CALOX12HTR1AMEN1 | |
| SCHEMBL19122704 | 0.67 | CES1 (0.53) | CES1HTR2CALOX12MEN1KMT2A | |
| SCHEMBL60540 | 0.64 | HTR2C (0.69) | CES1HTR2CALOX12HTR1ANISCH | |
| SCHEMBL29876651 | 0.64 | HTR1A (0.37) | CES1HTR1AMEN1KMT2A | |
| SCHEMBL11880068 | 0.63 | ROCK1 (0.50) | CES1MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL1762224 | 0.63 | CES1 (0.57) | CES1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4537888-A | Substituted benzoxazine derivatives and fungicidal use | BAYER AKTIENGESELLSCHAFT (DE) | 1985-08-27 | — | — | US | claimed |
| US-4537888-A | Substituted benzoxazine derivatives and fungicidal use | BAYER AKTIENGESELLSCHAFT (DE) | 1985-08-27 | — | — | US | disclosed |