Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CCR2 | P41597 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11616977 | 0.72 | PTGDR2 (0.39) | MEN1KMT2AHTTNPSR1GAA | |
| SCHEMBL11616397 | 0.70 | MEN1 (0.41) | MEN1KMT2AHTTNPSR1LMNA | |
| SCHEMBL11459956 | 0.69 | MAP3K14 (0.41) | MEN1KMT2APTGDR2CYP2C9CYP1A2 | |
| SCHEMBL11459811 | 0.69 | GCGR (0.39) | KMT2APTGDR2MAPTSMN1; SMN2 | |
| SCHEMBL11614807 | 0.67 | PTGDR2 (0.42) | MEN1KMT2AHTTNPSR1GAA | |
| Methane SCHEMBL11617514 | 0.65 | GAA (0.49) | HTTGAAPTGDR2CYP2C9MAPT | |
| SCHEMBL3494751 | 0.65 | ALDH1A1 (0.52) | MEN1KMT2AHTTNPSR1GAA | |
| SCHEMBL11471466 | 0.65 | MAPT (0.39) | MEN1KMT2AHTTGAAPTGDR2 | |
| SCHEMBL11464065 | 0.63 | VDR (0.41) | MEN1KMT2APTGDR2CYP2C9MAPT | |
| SCHEMBL11615839 | 0.63 | PTGDR2 (0.47) | HTTNPSR1GAAPTGDR2LMNA |
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-4117145-A | DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |
| US-4117143-A | USED AS ANTITHROMBOTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |
| US-4113957-A | DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-12 | — | — | US | disclosed |