Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 2/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | NAT1 | P18440 | 6/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.43 |
| ▸ | MYC | P01106 | 2/20 | 0.43 |
| ▸ | IL1RN | P18510 | 1/20 | 0.43 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.43 |
| ▸ | IGF1R | P08069 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14661290 | 0.79 | PIM1 (0.70) | PIM1NAT1CA2EPHX1ADAMTS5 | |
| SCHEMBL14661291 | 0.79 | PIM1 (0.70) | PIM1NAT1CA2EPHX1ADAMTS5 | |
| SCHEMBL13499565 | 0.79 | PIM1 (0.70) | PIM1NAT1CA2EPHX1ADAMTS5 | |
| SCHEMBL28544256 | 0.77 | PTP4A3 (0.62) | MTORMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL18102853 | 0.75 | NAT1 (0.62) | PIM1NAT1CA2EPHX1ADAMTS5 | |
| SCHEMBL3924263 | 0.75 | AKR1C3 (0.47) | MEN1ALDH1A1MAPTHPGDKMT2A | |
| SCHEMBL14660903 | 0.73 | PIM1 (0.62) | PIM1NAT1CA2EPHX1ADAMTS5 | |
| SCHEMBL13846835 | 0.73 | PIM1 (0.62) | PIM1NAT1CA2EPHX1ADAMTS5 | |
| SCHEMBL18102863 | 0.72 | PIM1 (0.51) | PIM1MEN1ALDH1A1LMNAMAPT | |
| SCHEMBL2857040 | 0.70 | AKR1C3 (0.64) | MEN1ALDH1A1LMNAMAPTHTT |
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-107428718-B | Preparation method of brexpiprazole analogue | 苏州旺山旺水生物医药有限公司 | 2021-04-27 | — | — | CN | disclosed |