Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.76 |
| ▸ | MEN1 | O00255 | 2/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.76 |
| ▸ | PKM | P14618 | 3/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.74 |
| ▸ | HTT | P42858 | 2/20 | 0.74 |
| ▸ | POLB | P06746 | 1/20 | 0.74 |
| ▸ | USP2 | O75604 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | HTR2C | P28335 | 1/20 | 0.59 |
| ▸ | HTR2B | P41595 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL23217199 | 0.93 | PKM (0.74) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL3812763 | 0.93 | KMT2A (0.86) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL18484219 | 0.93 | KMT2A (0.86) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL5564371 | 0.93 | KMT2A (0.86) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL15945283 | 0.93 | KMT2A (0.86) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL7645597 | 0.93 | KMT2A (0.86) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL3976265 | 0.92 | PKM (0.69) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| Bromide SCHEMBL1159786 | 0.92 | PKM (0.72) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL436674 | 0.91 | PKM (0.89) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 | |
| SCHEMBL1956663 | 0.90 | ALDH1A1 (0.70) | KMT2AMEN1SMN1; SMN2PKMALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020252457-A1 | PROCESSES AND COMPOUNDS FOR THE DECARBOXYLATIVE AMINATION OF REDOX-ACTIVE ESTERS WITH DIAZIRINES | H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) | 2020-12-17 | — | — | WO | disclosed |