Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.38 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.38 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.38 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 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 | |
|---|---|---|---|---|
| SCHEMBL18903328 | 0.90 | GPR3 (0.50) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL26589319 | 0.85 | GPR3 (0.48) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL19768707 | 0.84 | GPR3 (0.56) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL14798196 | 0.83 | GPR3 (0.47) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL11379095 | 0.83 | CYP1A2 (0.54) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL11382474 | 0.83 | GPR3 (0.47) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL2963097 | 0.82 | GPR3 (0.54) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL31081432 | 0.82 | GPR3 (0.54) | GPR3CYP1A2MAPTALDH1A1HPGD | |
| SCHEMBL14797740 | 0.82 | RORA (0.46) | GPR3ALDH1A1KDM4ELMNA | |
| SCHEMBL9193177 | 0.81 | CYP1A2 (0.62) | GPR3CYP1A2MAPTSMN1; SMN2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4285961-A | MICROBIOCIDES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-08-25 | — | — | US | disclosed |