Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 7/20 | 0.50 |
| ▸ | IP6K1 | Q92551 | 8/20 | 0.49 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.49 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL20268055 | 0.83 | PGR (0.47) | PGRIP6K1IP6K3IP6K2PDE4A | |
| SCHEMBL9773678 | 0.82 | IP6K1 (0.63) | PGRIP6K1IP6K3IP6K2PDE4A | |
| SCHEMBL20268826 | 0.81 | IP6K1 (0.55) | PGRIP6K1IP6K3IP6K2PDE4A | |
| SCHEMBL10520525 | 0.80 | IP6K1 (0.48) | PGRIP6K1IP6K3IP6K2 | |
| SCHEMBL20268320 | 0.78 | IP6K1 (0.55) | PGRIP6K1IP6K3IP6K2PDE4A | |
| SCHEMBL5680486 | 0.78 | PGR (0.50) | PGRALDH1A1MAPTPDE3BPDE3A | |
| SCHEMBL12548325 | 0.77 | IP6K1 (0.57) | PGRIP6K1IP6K3IP6K2ALDH1A1 | |
| SCHEMBL16849906 | 0.77 | IP6K1 (0.60) | PGRIP6K1IP6K3IP6K2 | |
| SCHEMBL8524882 | 0.76 | ALDH1A1 (0.47) | ALDH1A1MAPT | |
| SCHEMBL23590773 | 0.76 | PGR (0.40) | PGRPDE4APDE4BPDE4CPDE4D |
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-0281309-B1 | PIPERAZINYL-HETEROCYCLIC COMPOUNDS | PFIZER INC. (US) | 1991-12-27 | — | — | EP | disclosed |
| US-4883795-A | Piperazinyl-heterocyclic compounds | PFIZER INC. (US) | 1989-11-28 | — | — | US | disclosed |
| US-4831031-A | Aryl piperazinyl-(C2 or C4) alkylene heterocyclic compounds having neuroleptic activity | PFIZER INC. (US) | 1989-05-16 | — | — | US | disclosed |