Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.49 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2150867 | 0.81 | CYP1A2 (0.68) | NPSR1CYP1A2ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL14123121 | 0.81 | CYP1A2 (0.68) | NPSR1CYP1A2CYP3A4BRD4BRPF1 | |
| SCHEMBL12531935 | 0.79 | CYP1A2 (0.64) | NPSR1CYP1A2ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL2150911 | 0.78 | CYP1A2 (0.57) | NPSR1CYP1A2CYP3A4BRD4BRPF1 | |
| SCHEMBL7256405 | 0.76 | NPSR1 (0.79) | NPSR1ALDH1A1MAPK1SMN1; SMN2MAPT | |
| SCHEMBL11282667 | 0.76 | NPSR1 (0.52) | NPSR1CYP1A2ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL13488596 | 0.75 | NPSR1 (0.66) | NPSR1ALDH1A1SMN1; SMN2MAPTMEN1 | |
| SCHEMBL14129601 | 0.74 | NPSR1 (0.50) | NPSR1CYP1A2ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL16506763 | 0.74 | NPSR1 (0.50) | NPSR1CYP1A2ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL8145766 | 0.72 | CYP1A2 (0.67) | NPSR1CYP1A2CYP3A4BRD4BRPF1 |
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-0742218-B1 | PYRROLOPYRIDAZINE DERIVATIVE | SANKYO CO (JP) | 2002-12-04 | — | — | EP | disclosed |
| US-6063782-A | Pyrrolopyridazine derivatives | SANKYO COMPANY, LIMITED (JP) | 2000-05-16 | — | — | US | disclosed |
| EP-0742218-A1 | PYRROLOPYRIDAZINE DERIVATIVE | SANKYO COMPANY LIMITED (JP) | 1996-11-13 | — | — | EP | disclosed |