Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 3/20 | 0.34 |
| ▸ | CES1 | P23141 | 3/20 | 0.34 |
| ▸ | PPARG | P37231 | 6/20 | 0.33 |
| ▸ | PPARD | Q03181 | 6/20 | 0.33 |
| ▸ | PPARA | Q07869 | 6/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.33 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.33 |
| ▸ | TLR2 | O60603 | 2/20 | 0.33 |
| ▸ | FABP4 | P15090 | 2/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7998260 | 0.89 | MCL1 (0.43) | MCL1KMT2AMAPTHAO1ALDH1A1 | |
| SCHEMBL8010699 | 0.89 | MCL1 (0.43) | MCL1KMT2AMAPTHAO1ALDH1A1 | |
| SCHEMBL27987764 | 0.87 | KMT2A (0.54) | KMT2AMAPTTDP1HAO1ALDH1A1 | |
| SCHEMBL28525468 | 0.87 | KMT2A (0.54) | KMT2AMAPTTDP1HAO1ALDH1A1 | |
| SCHEMBL11247459 | 0.87 | KMT2A (0.54) | KMT2AMAPTTDP1HAO1ALDH1A1 | |
| SCHEMBL5462822 | 0.87 | KMT2A (0.54) | KMT2AMAPTTDP1HAO1ALDH1A1 | |
| SCHEMBL3708578 | 0.84 | KMT2A (0.50) | KMT2AMAPTTDP1HAO1ALDH1A1 | |
| SCHEMBL3899647 | 0.82 | — | — | |
| SCHEMBL609943 | 0.81 | — | — | |
| SCHEMBL13232045 | 0.81 | TDP1 (0.56) | KMT2AMAPTTDP1HAO1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000032671-A1 | PROCESS FOR THE PRODUCTION OF DIKETO DINITRILES AND POLYMERS DERIVED THEREFROM | COGNIS CORPORATION (US) | 2000-06-08 | — | — | WO | claimed |
| US-6048958-A | REACTION OF DIESTER WITH NITRILE TO FORM ALKALI METAL SALT AND ACIDIFICATION | HENKEL CORPORATION (US) | 2000-04-11 | — | — | US | claimed |