Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.43 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.43 |
| ▸ | GSTA1 | P08263 | 1/20 | 0.43 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.43 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MAP2K6 | P52564 | 1/20 | 0.43 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.43 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.43 |
| ▸ | PLIN5 | Q00G26 | 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 | |
|---|---|---|---|---|
| SCHEMBL11660813 | 1.00 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11604597 | 0.81 | CYP2C9 (0.67) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11604600 | 0.81 | CYP2C9 (0.67) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11451833 | 0.81 | GSTP1 (0.48) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL6136937 | 0.80 | ALDH1A1 (0.50) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL11386183 | 0.78 | MAPT (0.46) | ALDH1A1LMNAMAPTNPSR1CYP2C9 | |
| SCHEMBL13284005 | 0.78 | GSTP1 (0.70) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL8492183 | 0.77 | POLB (0.42) | ALDH1A1LMNAMAPTMEN1KMT2A | |
| SCHEMBL6931814 | 0.77 | TDP1 (0.55) | ALDH1A1MAPTMEN1KMT2ATSHR | |
| SCHEMBL30949565 | 0.77 | TDP1 (0.55) | ALDH1A1MAPTMEN1KMT2ATSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4085219-A | DIURETICS, SALURETICS, URICOSURIC AGENTS | MERCK & CO., INC. (US) | 1978-04-18 | — | — | US | disclosed |
| US-4081554-A | DIURETICS, SALURETICS, URICOSURICS | MERCK & CO., INC. (US) | 1978-03-28 | — | — | US | disclosed |
| US-3984465-A | DIURETIC, SALURETIC AND URICOSURIC | MERCK & CO., INC. (US) | 1976-10-05 | — | — | US | disclosed |