Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | BLM | P54132 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | FYN | P06241 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | APEX1 | P27695 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11601981 | 0.99 | ALDH1A1 (0.51) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| SCHEMBL6714716 | 0.90 | ALDH1A1 (0.52) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| Hydrochloric Acid SCHEMBL11328218 | 0.88 | ALDH1A1 (0.51) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| SCHEMBL11600302 | 0.78 | MAPT (0.57) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| Hydrochloric Acid SCHEMBL11602627 | 0.77 | MAPT (0.56) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| SCHEMBL9131214 | 0.76 | NOS1 (0.51) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| SCHEMBL12095295 | 0.75 | NOS1 (0.54) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| SCHEMBL6718046 | 0.74 | HPGD (0.56) | ALDH1A1BLMPOLBCYP1A2MEN1 | |
| SCHEMBL7903542 | 0.74 | NOS1 (0.61) | BLMPOLBCYP1A2MEN1KMT2A | |
| SCHEMBL8186885 | 0.74 | NOS1 (0.56) | ALDH1A1BLMPOLBCYP1A2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4034100-A | Antihypertensive agents | MERCK & CO., INC. (US) | 1977-07-05 | — | — | US | claimed |
| US-4034100-A | Antihypertensive agents | MERCK & CO., INC. (US) | 1977-07-05 | — | — | US | disclosed |