Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4429302 | 0.88 | PARP1 (0.36) | CYP2C19CYP3A4POLBALDH1A1TSHR | |
| SCHEMBL8565163 | 0.84 | TP53 (0.30) | TP53 | |
| SCHEMBL17779666 | 0.83 | CYP2C19 (0.36) | CYP2C19CYP3A4POLBALDH1A1CYP2C9 | |
| SCHEMBL19576702 | 0.80 | CYP2C19 (0.37) | CYP2C19CYP3A4ALDH1A1CYP2C9TSHR | |
| SCHEMBL10940755 | 0.79 | CYP2C19 (0.39) | CYP2C19CYP3A4POLBALDH1A1CYP2C9 | |
| SCHEMBL28043401 | 0.79 | CYP3A4 (0.36) | CYP2C19CYP3A4POLBALDH1A1SMN1; SMN2 | |
| SCHEMBL14880000 | 0.78 | CYP2C19 (0.39) | CYP2C19CYP3A4POLBALDH1A1CYP2C9 | |
| SCHEMBL8572306 | 0.78 | PARP1 (0.36) | ALDH1A1TSHRCYP2D6 | |
| SCHEMBL6907567 | 0.78 | CYP3A4 (0.39) | CYP3A4 | |
| SCHEMBL11106500 | 0.78 | CYP2C19 (0.37) | CYP2C19CYP3A4ALDH1A1TSHRMEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE35865-E | Preparation of glutaric acid derivatives | PFIZER INC. (US) | 1998-07-28 | — | — | US | disclosed |
| US-5714628-A | CARBOXYLATION A CYCLOHEXANONES TO A CYCLOPENTANECARBOXYLIC ACIDS WITH HYDROGEN PEROXIDE | PFIZER, INC. (US) | 1998-02-03 | — | — | US | disclosed |
| EP-0391673-B2 | Preparation of glutaric acid derivatives | PFIZER LTD (GB) | 1997-04-02 | — | — | EP | disclosed |
| US-5166406-A | Peroxidation of cyclohexanone derivatives | PFIZER INC. (US) | 1992-11-24 | — | — | US | disclosed |
| EP-0391673-A1 | Preparation of glutaric acid derivatives | Pfizer Limited (GB) | 1990-10-10 | — | — | EP | disclosed |