Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | CASP3 | P42574 | 1/20 | 0.57 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.57 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.57 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | CYTH2 | Q99418 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL17331322 | 0.88 | CYP2C9 (0.60) | METAP2ALDH1A1GAAHTTCASP3 | |
| SCHEMBL27884389 | 0.84 | CYP2C9 (0.63) | ALDH1A1GAAHTTKDM4ETSHR | |
| SCHEMBL7372057 | 0.81 | KDM4E (0.64) | ALDH1A1HTTCASP3SENP8SENP7 | |
| SCHEMBL578654 | 0.81 | FFAR4 (0.68) | METAP2ALDH1A1GAAHTTL3MBTL1 | |
| SCHEMBL29472171 | 0.81 | MCL1 (0.57) | METAP2ALDH1A1GAAHTTTSHR | |
| SCHEMBL28805203 | 0.81 | L3MBTL1 (0.55) | ALDH1A1GAAHTTL3MBTL1KDM4E | |
| SCHEMBL5329433 | 0.81 | NEU3 (0.60) | ALDH1A1L3MBTL1KDM4ETSHRHSD17B10 | |
| SCHEMBL2896693 | 0.81 | CYP2C9 (0.60) | ALDH1A1GAAKDM4ETSHRHSD17B10 | |
| SCHEMBL4955646 | 0.80 | CYTH2 (0.64) | METAP2ALDH1A1GAAHTTKDM4E | |
| SCHEMBL3724899 | 0.79 | FABP4 (0.59) | ALDH1A1KDM4ETSHRPTK2BHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007144379-A1 | BICYCLIC COMPOUNDS USEFUL AS CATHEPSIN S INBHIBITORS | MEDIVIR AB (SE) | 2007-12-21 | — | — | WO | disclosed |
| WO-2007144379-A1 | BICYCLIC COMPOUNDS USEFUL AS CATHEPSIN S INBHIBITORS | MEDIVIR AB (SE) | 2007-12-21 | — | — | WO | disclosed |
| CN-1149869-A | Substituted sulfonamides as selective beta3 agonists for treatment of diabetes and obesity | MERCK & CO LTD (US) | 1997-05-14 | — | — | CN | disclosed |