Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | ACAT1 | P24752 | 1/20 | 0.49 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9462849 | 0.83 | TSHR (0.49) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| Benzene SCHEMBL9216220 | 0.82 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| Benzene SCHEMBL7506348 | 0.80 | CYP1A2 (0.56) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| SCHEMBL18415560 | 0.80 | MAPT (0.51) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| SCHEMBL10683818 | 0.79 | MAPT (0.59) | TSHRKDM4ETP53CYP3A4MAPT | |
| SCHEMBL30977634 | 0.79 | CYP3A4 (0.48) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| SCHEMBL7959792 | 0.78 | MAPT (0.50) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| Benzene SCHEMBL7505676 | 0.77 | HPGD (0.44) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| SCHEMBL7959789 | 0.77 | CYP3A4 (0.49) | ALDH1A1TSHRKDM4ETP53CYP3A4 | |
| SCHEMBL9641181 | 0.77 | CYP3A4 (0.49) | ALDH1A1TSHRKDM4ETP53CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991015464-A1 | AMIDE ESTER ACAT INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1991-10-17 | — | — | WO | claimed |
| WO-1991015464-A1 | AMIDE ESTER ACAT INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1991-10-17 | — | — | WO | disclosed |