Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.71 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.71 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.71 |
| ▸ | CES1 | P23141 | 8/20 | 0.71 |
| ▸ | BCHE | P06276 | 3/20 | 0.71 |
| ▸ | CDC25A | P30304 | 1/20 | 0.69 |
| ▸ | PKM | P14618 | 1/20 | 0.65 |
| ▸ | TGM2 | P21980 | 1/20 | 0.61 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.59 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL4597174 | 0.98 | CES1 (0.72) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL2149622 | 0.95 | CES1 (0.73) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL25119569 | 0.91 | CES1 (0.85) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL25119255 | 0.90 | CES1 (0.84) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL7824511 | 0.88 | CES1 (0.79) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL19924204 | 0.84 | CES1 (1.00) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL281625 | 0.83 | ALDH1A1 (1.00) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL11148969 | 0.83 | CES1 (0.78) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL281618 | 0.83 | CES1 (0.76) | ALDH1A1ALDH2ALDH3A1CES1BCHE | |
| SCHEMBL2149331 | 0.83 | CES1 (0.83) | ALDH1A1ALDH2ALDH3A1CES1BCHE |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0060610-B1 | HEXAHYDRO-TRANS- AND TETRAHYDROPYRIDOINDOLE NEUROLEPTIC AGENTS | PFIZER INC. (US) | 1985-09-04 | — | — | EP | disclosed |
| US-4432978-A | NEUROLEPTIC AGENTS, TRANQUILIZERS | PFIZER INC. (US) | 1984-02-21 | — | — | US | disclosed |
| US-4431649-A | TRANQUILIZERS | PFIZER INC. (US) | 1984-02-14 | — | — | US | disclosed |
| US-4431646-A | TRANQUILIZERS; PSYCHOSIS; NERVOUS SYSTEM DISORDERS | PFIZER INC. (US) | 1984-02-14 | — | — | US | disclosed |
| US-4427679-A | TRANQUILIZERS; PSYCHOLOGICAL DISORDERS | PFIZER INC. (US) | 1984-01-24 | — | — | US | disclosed |
| EP-0060610-A1 | Hexahydro-trans- and tetrahydropyridoindole neuroleptic agents | PFIZER INC. (US) | 1982-09-22 | — | — | EP | disclosed |
| US-4337250-A | NEUROLEPTIC AGENTS | PFIZER INC. (US) | 1982-06-29 | — | — | US | disclosed |