Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.69 |
| ▸ | CNR2 | P34972 | 5/20 | 0.62 |
| ▸ | CNR1 | P21554 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8340562 | 0.90 | MAOB (0.55) | MAOBCNR2CNR1ALDH1A1CYP1A2 | |
| SCHEMBL11599683 | 0.90 | MAOB (0.59) | MAOBCNR2CNR1ALDH1A1CYP1A2 | |
| SCHEMBL11599871 | 0.87 | MAOB (0.53) | MAOBCNR2CNR1ALDH1A1CYP1A2 | |
| SCHEMBL8341825 | 0.85 | ESR1 (0.50) | MAOBCNR2CNR1ALDH1A1CYP1A2 | |
| SCHEMBL11733660 | 0.85 | CNR2 (0.57) | MAOBCNR2CNR1ALDH1A1HPGD | |
| SCHEMBL8338493 | 0.85 | ESR1 (0.60) | MAOBMEN1KMT2AMAPTRAB9A | |
| SCHEMBL11599882 | 0.83 | GABRA1 (0.66) | MAOBALDH1A1CYP1A2ADORA1ADORA3 | |
| SCHEMBL11601813 | 0.83 | CNR2 (0.53) | MAOBCNR2CNR1 | |
| SCHEMBL11598733 | 0.83 | ADORA1 (0.53) | MAOBCNR2CNR1ALDH1A1HPGD | |
| SCHEMBL8341393 | 0.82 | MAOB (0.74) | MAOBCNR2CNR1CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5908859-A | ESPECIALLY HYPERCHOLESTEROLEMIA | ELI LILLY AND COMPANY (US) | 1999-06-01 | — | — | US | disclosed |
| EP-0897918-A1 | Benzothiophene derivatives and their use as pharmaceutically active agents | ELI LILLY AND COMPANY (US) | 1999-02-24 | — | — | EP | disclosed |
| US-4075227-A | NONSTEROIDAL | ELI LILLY AND COMPANY (US) | 1978-02-21 | — | — | US | disclosed |