Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | RARB | P10826 | 6/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | RARA | P10276 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL9633693 | 0.81 | FFAR1 (0.55) | ALDH1A1L3MBTL1HSD17B10TRPV1 | |
| SCHEMBL1647450 | 0.79 | ALDH1A1 (0.52) | ALDH1A1RARBKMT2AMEN1MAPT | |
| SCHEMBL28582518 | 0.78 | BACE1 (0.50) | MAPTTSHRKDM4EPOLBRECQL | |
| SCHEMBL105976 | 0.78 | TRPV1 (0.51) | ALDH1A1SMN1; SMN2TDP1HSD17B10HPGD | |
| SCHEMBL28734241 | 0.78 | ALDH1A1 (0.52) | ALDH1A1RARBKMT2AMEN1MAPT | |
| SCHEMBL27489703 | 0.78 | ALDH1A1 (0.52) | ALDH1A1RARBKMT2AMEN1MAPT | |
| SCHEMBL8759256 | 0.78 | ALDH1A1 (0.57) | ALDH1A1RARBKMT2AMEN1MAPT | |
| SCHEMBL70166 | 0.77 | TSHR (0.67) | ALDH1A1RARBKMT2AMEN1MAPT | |
| Terephthalic Acid SCHEMBL4612225 | 0.77 | TSHR (0.67) | ALDH1A1RARBKMT2AMEN1MAPT | |
| SCHEMBL3102413 | 0.77 | ALDH1A1 (0.54) | ALDH1A1RARBKMT2AMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0513761-A2 | Bisphosphonate squalene synthetase inhibitors | E.R. SQUIBB & SONS, INC. (US) | 1992-11-19 | — | — | EP | disclosed |
| US-5157027-A | Anticholesterol agents | E. R. SQUIBB & SONS, INC. (US) | 1992-10-20 | — | — | US | disclosed |