Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTPRA | P18433 | 1/20 | 0.34 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.34 |
| ▸ | BCKDK | O14874 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SCD | O00767 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2170975 | 0.90 | HDAC1 (0.36) | HDAC1P2RX7PTPN1PTPRAADAMTS5 | |
| SCHEMBL2171600 | 0.78 | NPC1 (0.40) | HDAC1PTPN1PTPRAADAMTS5BCKDK | |
| SCHEMBL2169644 | 0.69 | PTPN1 (0.55) | PTPN1PTPRAKMT2AMEN1MAPT | |
| SCHEMBL4194300 | 0.68 | PTPN1 (0.53) | PTPN1PTPRAKMT2AMEN1MAPT | |
| SCHEMBL2170705 | 0.66 | GPR35 (0.32) | MCL1 | |
| SCHEMBL28792719 | 0.66 | ALDH1A1 (0.32) | TSHRALDH1A1 | |
| SCHEMBL21523601 | 0.61 | SCD5 (0.59) | PTPN1SCD5MAPTSCDALDH1A1 | |
| SCHEMBL27839229 | 0.61 | RAB9A (0.59) | KMT2AMEN1MAPTLMNAL3MBTL1 | |
| SCHEMBL12344851 | 0.61 | MEN1 (0.37) | ADAMTS5FABP4FABP5KMT2ASCD5 | |
| SCHEMBL24970240 | 0.60 | MAPT (0.40) | HDAC1ADAMTS5KMT2AMEN1MAPT |
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-102245600-A | Pyrrolone melanin concentrating hormone receptor-1 antagonists | BRISTOL MYERS SQUIBB CO | 2011-11-16 | — | — | CN | disclosed |