Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KLK7 | P49862 | 1/20 | 0.40 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.38 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31224683 | 0.75 | NPC1 (0.48) | ALDH1A1CYP1A2GAACYP2C9CYP2C19 | |
| SCHEMBL1463746 | 0.75 | MAPT (0.47) | KMOALDH1A1CYP1A2GAACYP2C9 | |
| SCHEMBL21200228 | 0.73 | ALDH1A1 (0.54) | ALDH1A1HDAC2MAP4K4MAPK1HSD17B10 | |
| SCHEMBL898443 | 0.73 | ALDH1A1 (0.45) | ALDH1A1NPC1MPL | |
| SCHEMBL30873896 | 0.71 | SMN1; SMN2 (0.44) | ALDH1A1CYP1A2CYP2C9CYP2C19RAB9A | |
| SCHEMBL30738324 | 0.71 | ALDH1A1 (0.50) | ALDH1A1CYP1A2GAACYP2C9CYP2C19 | |
| SCHEMBL22179700 | 0.71 | ALDH1A1 (0.50) | ALDH1A1CYP1A2GAACYP2C9CYP2C19 | |
| SCHEMBL24067959 | 0.71 | LMNA (0.42) | ALDH1A1GAARAB9ANPC1MAP4K4 | |
| SCHEMBL126685 | 0.70 | MPL (0.69) | ALDH1A1RAB9ANPC1SMN1; SMN2KDM4E | |
| SCHEMBL4053052 | 0.70 | MAP2K3 (0.56) | ALDH1A1RAB9ANPC1SMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007020521-A1 | PYRIDOYRAZINONES AS PDE-5 INHIBITORS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2007-02-22 | — | — | WO | disclosed |