Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6818321 | 0.84 | MAOB (0.72) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL31568895 | 0.84 | MAOB (0.72) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL6818320 | 0.84 | MAOB (0.72) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL4459220 | 0.83 | MAOB (0.48) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL4459217 | 0.83 | MAOB (0.48) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL4459214 | 0.83 | MAOB (0.48) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL6818340 | 0.83 | MAOB (0.56) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL9495004 | 0.83 | MAOB (0.56) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL6818344 | 0.83 | MAOB (0.56) | MAOBNFKB1MAPTLMNAMEN1 | |
| SCHEMBL4471256 | 0.81 | LMNA (0.53) | MAOBNFKB1LMNAALDH1A1MAOA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1778225-A2 | PYRROLO(OXO)ISOQUINOLINES AS 5HT LIGANDS | Bristol-Myers Squibb Company (US) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006019886-A2 | PYRROLO(OXO)ISOQUINOLINES AS 5HT LIGANDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-02-23 | — | — | WO | disclosed |