Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 3/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | XIAP | P98170 | 2/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10914659 | 1.00 | NOTUM (0.34) | NOTUMS1PR5PDE4APDE4BPDE4C | |
| SCHEMBL10652511 | 1.00 | NOTUM (0.34) | NOTUMS1PR5PDE4APDE4BPDE4C | |
| SCHEMBL10654980 | 0.89 | NOTUM (0.36) | NOTUMPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL10472684 | 0.83 | PDE4A (0.34) | PDE4APDE4BPDE4CPDE4DOPRM1 | |
| SCHEMBL10482582 | 0.82 | GRM2 (0.35) | PDE4APDE4BPDE4CPDE4DXIAP | |
| SCHEMBL10911905 | 0.77 | LMNA (0.34) | PDE4APDE4BPDE4CPDE4DS1PR1 | |
| SCHEMBL10655923 | 0.75 | USP2 (0.34) | PDE4APDE4BPDE4CPDE4DOPRM1 | |
| SCHEMBL10656604 | 0.74 | PDE4A (0.36) | PDE4APDE4BPDE4CPDE4DS1PR1 | |
| SCHEMBL10474997 | 0.74 | CHRNB4 (0.36) | PDE4APDE4BPDE4CPDE4DOPRM1 | |
| SCHEMBL10473370 | 0.74 | CHRNB4 (0.36) | PDE4APDE4BPDE4CPDE4DOPRM1 |
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-0090516-B1 | SUBSTITUTED HEXAHYDROPYRROLO(1,2-A)-QUINOLINE, HEXAHYDRO-1H-PYRIDO(1,2-A)-QUINOLINE, HEXAHYDROBENZO(3)INDENE AND OCTAHYDROPHENANTHRENE CNS AGENTS | PFIZER INC. (US) | 1988-07-06 | — | — | EP | disclosed |
| US-4576964-A | ANALGESICS, ANTIEMETICS | PFIZER INC. (US) | 1986-03-18 | — | — | US | disclosed |
| US-4476131-A | ANTIEMETICS, ANALGESICS | PFIZER INC. (US) | 1984-10-09 | — | — | US | disclosed |