Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8314257 | 0.94 | MAPT (0.47) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL9738512 | 0.89 | CYP3A4 (0.67) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL8314761 | 0.89 | TSHR (0.45) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL4590906 | 0.86 | CYP3A4 (0.52) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL8317417 | 0.85 | LMNA (0.53) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL8313031 | 0.82 | CYP1A2 (0.49) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL9739298 | 0.81 | CYP3A4 (0.54) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL8314111 | 0.79 | CYP1A2 (0.46) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL9740627 | 0.79 | CYP1A2 (0.61) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL8316435 | 0.79 | CYP3A4 (0.49) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 |
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-0609328-B1 | PYRROLO-PYRIDAZINES WITH GASTRO-INTESTINAL PROTECTIVE ACTION | BYK GULDEN LOMBERG CHEM FAB (DE) | 1999-04-28 | — | — | EP | disclosed |
| US-5534515-A | Pyrrolopyridazines having gastrointestinal protective effects | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1996-07-09 | — | — | US | disclosed |
| WO-1993008190-A1 | PYRROLO-PYRIDAZINES WITH GASTRO-INTESTINAL PROTECTIVE ACTION | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1993-04-29 | — | — | WO | disclosed |