Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | SNCA | P37840 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | FBP1 | P09467 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28029994 | 1.00 | MAOB (0.47) | MAOBBCHEBRAFCES2CES1 | |
| SCHEMBL28030387 | 0.95 | CYP1B1 (0.47) | MAOBBCHECES2CES1MEN1 | |
| SCHEMBL28029992 | 0.95 | CYP1B1 (0.47) | MAOBBCHECES2CES1MEN1 | |
| SCHEMBL28029985 | 0.84 | MEN1 (0.44) | MEN1KMT2APOLBKDM4EMAPT | |
| SCHEMBL28029983 | 0.84 | MEN1 (0.44) | MEN1KMT2APOLBKDM4EMAPT | |
| SCHEMBL28029978 | 0.81 | KMT2A (0.39) | MEN1KMT2APOLBKDM4ENPC1 | |
| SCHEMBL28030374 | 0.81 | PTGS2 (0.45) | MAOBCES2CES1MEN1KMT2A | |
| SCHEMBL28030362 | 0.81 | PTGS2 (0.45) | MEN1KMT2APOLBSNCANPC1 | |
| SCHEMBL28029984 | 0.77 | ALDH1A1 (0.50) | MEN1KMT2ASNCAKDM4ENPC1 | |
| SCHEMBL22493010 | 0.76 | AKR1C1 (0.46) | MAOBBCHEMEN1KMT2APOLB |
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-104926867-A | Preparation method for alkenyl phosphate compound | UNIV BEIJING | 2015-09-23 | — | — | CN | disclosed |