Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.34 |
| ▸ | CA4 | P22748 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CA3 | P07451 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL56599 | 0.83 | ALDH1A1 (0.65) | ALDH1A1HSD17B10TDP1CA1CA2 | |
| SCHEMBL27829 | 0.77 | SMN1; SMN2 (0.40) | ALDH1A1HSD17B10CA1CA2GAA | |
| SCHEMBL1237755 | 0.77 | ALDH1A1 (0.57) | ALDH1A1HSD17B10TDP1CA1CA2 | |
| SCHEMBL7526388 | 0.77 | CA2 (0.70) | CA1CA2LMNACA12CA9 | |
| SCHEMBL2264686 | 0.76 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TDP1CA1CA2 | |
| SCHEMBL10408548 | 0.76 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TDP1CA1CA2 | |
| SCHEMBL3191992 | 0.76 | HTR6 (0.61) | ALDH1A1LMNATSHRHTR6KMT2A | |
| SCHEMBL16000 | 0.74 | ALDH1A1 (0.54) | ALDH1A1HSD17B10TDP1KMT2AMEN1 | |
| SCHEMBL29422524 | 0.74 | ALDH1A1 (0.54) | ALDH1A1HSD17B10TDP1KMT2AMEN1 | |
| SCHEMBL2536096 | 0.74 | PSIP1 (0.56) | ALDH1A1CA1CA2TSHRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0804428-A1 | BIS-SULFONAMIDE HYDROXYETHYLAMINO RETROVIRAL PROTEASE INHIBITORS | G.D. SEARLE & CO. (US) | 1997-11-05 | — | — | EP | disclosed |