Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GALR3 | O60755 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.41 |
| ▸ | STS | P08842 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1838707 | 0.86 | CYP19A1 (0.55) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7572092 | 0.84 | CYP19A1 (0.56) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29038973 | 0.80 | CYP19A1 (0.52) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7571033 | 0.79 | AR (0.44) | TSHRFNTAFNTBPGGT1B | |
| SCHEMBL31772593 | 0.79 | ESR2 (0.59) | CYP19A1ALDH1A1ESR2TRPA1TSHR | |
| SCHEMBL357 | 0.79 | ESR2 (0.59) | CYP19A1ALDH1A1ESR2TRPA1TSHR | |
| SCHEMBL21083705 | 0.78 | CYP19A1 (0.43) | CYP19A1MAOBMAOASTSESR2 | |
| SCHEMBL7307658 | 0.78 | CYP19A1 (0.56) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7137268 | 0.78 | CYP19A1 (0.50) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1373277 | 0.77 | ALDH1A1 (0.48) | ALDH1A1ESR2TRPA1TSHRMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6077853-A | Inhibitors of farnesyl-protein transferase | MERCK & CO., INC. (US) | 2000-06-20 | — | — | US | disclosed |
| EP-0951285-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 1999-10-27 | — | — | EP | disclosed |
| US-5939439-A | Inhibitors of farnesyl-protein transferase | MERCK & CO., INC. (US) | 1999-08-17 | — | — | US | disclosed |
| WO-1998029119-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1998-07-09 | — | — | WO | disclosed |