Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23980624 | 0.89 | NCF1 (0.40) | ADORA1HDAC2HDAC8HDAC6CYP1A1 | |
| SCHEMBL12695592 | 0.82 | BACE1 (0.57) | ADORA1HPGDBACE1PDGFRBPDGFRA | |
| SCHEMBL16573997 | 0.82 | PDGFRB (0.46) | ADORA1HPGDBACE1HDAC2HDAC8 | |
| SCHEMBL7843173 | 0.81 | L3MBTL1 (0.41) | ADORA1HPGDBACE1HDAC2HDAC8 | |
| SCHEMBL10365992 | 0.78 | TEK (0.37) | PDGFRBPDGFRACYP1A2 | |
| SCHEMBL20047071 | 0.78 | BACE1 (0.65) | BACE1PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL10366536 | 0.76 | KCNH2 (0.49) | ADORA1 | |
| SCHEMBL10366215 | 0.76 | ADORA1 (0.38) | ADORA1HPGDBACE1HDAC2HDAC8 | |
| SCHEMBL28147640 | 0.75 | ESR1 (0.44) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL10365973 | 0.75 | ERN1 (0.49) | HPGDHDAC2HDAC8HDAC6 |
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-0190857-B1 | QUINOLONE INOTROPIC AGENTS | Pfizer Limited (GB) | 1990-03-21 | — | — | EP | disclosed |
| US-4728654-A | CONGESTIVE HEART FAILURE | PFIZER INC. (US) | 1988-03-01 | — | — | US | disclosed |
| EP-0190857-A2 | Quinolone inotropic agents | Pfizer Limited (GB) | 1986-08-13 | — | — | EP | disclosed |