Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.38 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | BMP1 | P13497 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL14720671 | 0.80 | PDPK1 (0.46) | MTNR1BPDPK1AKR1B1AKR1A1P2RX7 | |
| SCHEMBL3883372 | 0.74 | PDPK1 (0.56) | MTNR1BPDPK1AKR1B1P2RX7BMP1 | |
| SCHEMBL2818682 | 0.74 | PDPK1 (0.56) | MTNR1BPDPK1AKR1B1AKR1A1NPC1 | |
| SCHEMBL12069956 | 0.73 | MEN1 (0.46) | MTNR1BPDPK1AKR1B1DGAT1MAPT | |
| SCHEMBL13034145 | 0.73 | MEN1 (0.53) | MTNR1BPDPK1AKR1B1P2RX7DGAT1 | |
| SCHEMBL8828 | 0.72 | CA2 (0.54) | MTNR1BPDPK1AKR1B1AKR1A1NPC1 | |
| SCHEMBL6691430 | 0.72 | TYR (0.47) | MTNR1BPDPK1AKR1B1P2RX7NPC1 | |
| SCHEMBL28414815 | 0.71 | PDPK1 (0.40) | MTNR1BPDPK1AKR1B1AKR1A1BMP1 | |
| SCHEMBL2130306 | 0.71 | PDPK1 (0.52) | MTNR1BPDPK1AKR1B1AKR1A1P2RX7 | |
| SCHEMBL28679792 | 0.71 | DGAT1 (0.47) | MTNR1BPDPK1AKR1B1AKR1A1BMP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1714079-A | Mandelic acid derivatives | HOFFMANN LA ROCHE (CH) | 2005-12-28 | — | — | CN | disclosed |