Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9512964 | 1.00 | MAOB (0.53) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL11059564 | 0.98 | MAOB (0.52) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL11059571 | 0.98 | MAOB (0.52) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL10480082 | 0.98 | MAOB (0.52) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL10480078 | 0.98 | MAOB (0.52) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL9626351 | 0.96 | MAOB (0.50) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL9626358 | 0.96 | MAOB (0.50) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL9626360 | 0.96 | MAOB (0.50) | MAOBCALM1CASP3SENP8SENP7 | |
| SCHEMBL11062134 | 0.95 | MAOB (0.55) | MAOBCALM1TAAR1SIGMAR1 | |
| SCHEMBL11062137 | 0.95 | MAOB (0.55) | MAOBCALM1TAAR1SIGMAR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0247466-B1 | Liquid-crystal derivatives of phenyl benzoate | HOFFMANN LA ROCHE (CH) | 1993-11-24 | — | — | EP | disclosed |
| US-5082589-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1992-01-21 | — | — | US | disclosed |
| US-4925278-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1990-05-15 | — | — | US | disclosed |
| US-4830470-A | Liquid crystalline esters | HOFFMANN-LA ROCHE INC. (US) | 1989-05-16 | — | — | US | disclosed |
| EP-0247466-A2 | Liquid-crystal derivatives of phenyl benzoate | F. HOFFMANN-LA ROCHE AG (CH) | 1987-12-02 | — | — | EP | disclosed |
| US-4439015-A | Disubstituted ethanes | HOFFMANN-LA ROCHE INC. (US) | 1984-03-27 | — | — | US | disclosed |