Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 3/20 | 0.50 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.47 |
| ▸ | ACP1 | P24666 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 2/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.46 |
| ▸ | PTAFR | P25105 | 3/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9849674 | 0.96 | GBA1 (0.49) | GBA1MKNK1MKNK2ACP1TDP1 | |
| Hydrochloric Acid SCHEMBL9849411 | 0.89 | MKNK1 (0.55) | GBA1MKNK1MKNK2L3MBTL1NOS1 | |
| SCHEMBL5943486 | 0.78 | NCF1 (0.59) | KDM4ENPC1TP53HPGDHTT | |
| SCHEMBL9706440 | 0.76 | LTA4H (0.63) | GBA1TDP1L3MBTL1HRH1PTAFR | |
| SCHEMBL9849857 | 0.75 | GBA1 (0.67) | GBA1ACP1PTAFRTP53HSD17B10 | |
| Fumaric Acid SCHEMBL9849620 | 0.75 | PTAFR (0.46) | L3MBTL1PTAFRTBXAS1 | |
| SCHEMBL1234357 | 0.74 | NCF1 (0.55) | L3MBTL1KDM4ENPC1TP53HPGD | |
| SCHEMBL8354796 | 0.74 | NCF1 (0.50) | KDM4ENPC1TP53HPGDHTT | |
| SCHEMBL4848123 | 0.74 | NCF1 (0.50) | KDM4ENPC1TP53HPGDHTT | |
| SCHEMBL5943483 | 0.74 | SIGMAR1 (0.51) | KDM4ENPC1TP53HPGDHTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0446604-A2 | Pyridine and related aza heterocycle derivatives as cardiovascular agents | AMERICAN CYANAMID COMPANY (US) | 1991-09-18 | — | — | EP | disclosed |