Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3827366 | 0.82 | AKR1C3 (0.37) | MEN1KMT2ASMN1; SMN2POLB | |
| SCHEMBL7715157 | 0.81 | CA12 (0.45) | ALDH1A1CA1CA9NCEH1LMNA | |
| SCHEMBL7718988 | 0.78 | ALDH1A1 (0.38) | ALDH1A1CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL3827000 | 0.77 | CYP2A6 (0.45) | ALDH1A1MEN1KMT2AESR1ESR2 | |
| SCHEMBL3825115 | 0.75 | NCEH1 (0.42) | NCEH1PTPN1 | |
| SCHEMBL1007952 | 0.70 | GPR119 (0.42) | — | |
| SCHEMBL1007329 | 0.68 | MT-CO2 (0.51) | ALDH1A1MEN1KMT2ASMN1; SMN2TDP1 | |
| SCHEMBL1008034 | 0.68 | MT-CO2 (0.39) | ALDH1A1MEN1KMT2AATMSMN1; SMN2 | |
| SCHEMBL20364928 | 0.67 | L3MBTL1 (0.56) | ALDH1A1MEN1KMT2ACA1CA2 | |
| SCHEMBL4556628 | 0.67 | ALOX15 (0.40) | ALDH1A1MEN1KMT2AATMSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1214326-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001018006-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-03-15 | — | — | WO | disclosed |