Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | HTR3A | P46098 | 2/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | CHRND | Q07001 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4236987 | 0.83 | SLC6A4 (0.33) | SLC6A2SLC6A4SLC6A3KDM1A | |
| SCHEMBL5851728 | 0.83 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3CHRNA1CHRNG | |
| SCHEMBL6814611 | 0.83 | SLC6A2 (0.56) | SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL10723779 | 0.82 | SLC6A2 (0.34) | SLC6A2SLC6A4SLC6A3CHRNA1CHRNG | |
| SCHEMBL4733564 | 0.80 | MAOA (0.33) | SLC6A2SLC6A4SLC6A3CHRNA1CHRNG | |
| SCHEMBL4238688 | 0.80 | DRD2 (0.39) | DRD2SLC6A2SLC6A4SLC6A3HTR3A | |
| SCHEMBL894578 | 0.75 | MAPT (0.42) | — | |
| SCHEMBL894577 | 0.75 | MAPT (0.42) | — | |
| SCHEMBL3044635 | 0.75 | DRD2 (0.41) | DRD2SLC6A2SLC6A4SLC6A3HTR3A | |
| SCHEMBL17488162 | 0.67 | MAOA (0.40) | MAOAMAOB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0958287-B2 | SULFAMIDE-METALLOPROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-04-09 | — | — | EP | disclosed |
| EP-0958287-B1 | SULFAMIDE-METALLOPROTEASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2002-09-11 | — | — | EP | disclosed |
| US-4711899-A | 2-(4-benzoyl-1-piperidyl)-1-phenylalkanol derivatives | SYNTHELABO (FR) | 1987-12-08 | — | — | US | disclosed |