Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.43 |
| ▸ | MEN1 | O00255 | 7/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TPH1 | P17752 | 3/20 | 0.40 |
| ▸ | TPH2 | Q8IWU9 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19090590 | 0.75 | ALDH1A1 (0.49) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL21389555 | 0.75 | ALDH1A1 (0.46) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL19090589 | 0.73 | MAPT (0.49) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL19090586 | 0.71 | KDM4E (0.49) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL19090392 | 0.71 | ALDH1A1 (0.45) | ALDH1A1KDM4EKMT2AMEN1HTT | |
| SCHEMBL19090561 | 0.70 | HRH3 (0.46) | ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL9323014 | 0.66 | MAOB (0.53) | ALDH1A1SMN1; SMN2NPSR1RAB9AHPGD | |
| SCHEMBL19090391 | 0.66 | MEN1 (0.45) | ALDH1A1KDM4EKMT2AMEN1NPSR1 | |
| SCHEMBL8465794 | 0.66 | MAOB (0.54) | ALDH1A1KMT2AMEN1SMN1; SMN2PKM | |
| SCHEMBL19066314 | 0.65 | MEN1 (0.65) | ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3397640-B1 | XANTHINE DERIVATIVE INHIBITORS OF BET PROTEINS | INST NAT SANTE RECH MED (FR) | 2021-08-04 | — | — | EP | disclosed |
| WO-2017114843-A1 | XANTHINE DERIVATIVE INHIBITORS OF BET PROTEINS | INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) | 2017-07-06 | — | — | WO | disclosed |