Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | THRA | P10827 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.48 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11818781 | 0.91 | TP53 (0.54) | TP53THRAALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL8186880 | 0.87 | TP53 (0.61) | TP53CES2CES1THRATSHR | |
| SCHEMBL11819341 | 0.86 | NR4A2 (0.48) | TP53MAPT | |
| Dinitrophenylene SCHEMBL28982637 | 0.84 | TP53 (0.82) | TP53CES2CES1TSHRALDH1A1 | |
| SCHEMBL10918542 | 0.82 | TSHR (0.71) | CES2CES1THRATSHRALDH1A1 | |
| SCHEMBL28833172 | 0.82 | PKM (0.56) | TP53TSHRALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL11821796 | 0.81 | POLB (0.52) | TP53THRAALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL29864638 | 0.81 | TSHR (0.65) | THRATSHRALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL5250015 | 0.81 | TSHR (0.65) | THRATSHRALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL13240466 | 0.81 | TP53 (0.61) | TP53CES2CES1THRAALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3954994-A | Intermediates for preparing hipolipemic agents and method of lowering the blood lipid level in mammals with said agents | PFIZER INC. (US) | 1976-05-04 | — | — | US | disclosed |