Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 3/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | FNTA | P49354 | 1/20 | 0.36 |
| ▸ | FNTB | P49356 | 1/20 | 0.36 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7710770 | 0.89 | AR (0.39) | S1PR3ARCACNA1HCYP11B1CYP11B2 | |
| SCHEMBL7672909 | 0.78 | CYP17A1 (0.48) | CYP11B1CYP11B2CYP3A4CYP17A1FNTA | |
| SCHEMBL7717657 | 0.76 | TRPA1 (0.41) | S1PR3ARCACNA1HSLC22A12S1PR1 | |
| SCHEMBL7707858 | 0.74 | HIF1A (0.36) | CACNA1HPOLBFNTAFNTBPGGT1B | |
| SCHEMBL7704743 | 0.70 | CYP11B1 (0.55) | CACNA1HCYP11B1CYP11B2FNTAFNTB | |
| SCHEMBL7736904 | 0.69 | S1PR3 (0.42) | S1PR3CACNA1HCYP11B1CYP11B2CYP3A4 | |
| SCHEMBL7713236 | 0.69 | CYP11B1 (0.70) | CACNA1HCYP11B1CYP11B2FNTAFNTB | |
| Hydrochloric Acid SCHEMBL7220321 | 0.68 | FNTA (0.41) | S1PR3CACNA1HCYP3A4CYP17A1FNTA | |
| SCHEMBL5359320 | 0.68 | CNR1 (0.45) | S1PR3ARCACNA1HCYP11B1CYP11B2 | |
| SCHEMBL7673750 | 0.68 | FNTA (0.44) | S1PR3CYP11B1CYP11B2CYP3A4CYP17A1 |
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-6441017-B1 | Inhibitors of prenyl-protein transferase | MERCK & CO., INC. | 2002-08-27 | — | — | US | disclosed |
| US-6358985-B1 | ANTICANCER AGENT | MERCK & CO., INC. | 2002-03-19 | — | — | US | disclosed |