Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | ALPI | P09923 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7168198 | 0.81 | ALDH1A1 (0.45) | ALDH1A1GAAKDM4EHPGDCA2 | |
| SCHEMBL6258308 | 0.80 | IDO1 (0.60) | ALDH1A1GAAIDO1CA2CA12 | |
| SCHEMBL2058113 | 0.78 | ALDH1A1 (0.50) | ALDH1A1GAAKDM4EHPGDCA2 | |
| SCHEMBL8000896 | 0.74 | KDM4E (0.40) | ALDH1A1GAAKDM4EHPGDCA2 | |
| SCHEMBL1640006 | 0.74 | IDO1 (0.45) | GAAHPGDIDO1KMT2A | |
| SCHEMBL9957685 | 0.73 | CA12 (0.54) | ALDH1A1GAAKDM4EHPGDCA2 | |
| SCHEMBL7420399 | 0.73 | CA2 (0.47) | ALDH1A1GAAKDM4EIDO1CA2 | |
| SCHEMBL11450751 | 0.72 | ALDH1A1 (0.50) | ALDH1A1GAAKDM4EHPGDCA2 | |
| SCHEMBL9956982 | 0.72 | CA12 (0.52) | ALDH1A1GAAKDM4EHPGDCA2 | |
| SCHEMBL3593702 | 0.71 | IDO1 (0.46) | ALDH1A1IDO1CA2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1090012-A4 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO INC (US) | 2005-04-06 | — | — | EP | disclosed |
| US-6562823-B1 | Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar | MERCK & CO., INC. | 2003-05-13 | — | — | US | disclosed |
| EP-1090012-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 2001-04-11 | — | — | EP | disclosed |
| WO-2000001702-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2000-01-13 | — | — | WO | disclosed |