Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 12/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 12/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | FBP1 | P09467 | 1/20 | 0.48 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.45 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13790333 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL7567897 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL8367958 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL13790243 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL7284153 | 0.81 | CYP1A1 (0.50) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL9870374 | 0.81 | CYP1A1 (0.50) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL27960206 | 0.81 | CYP1A1 (0.50) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL27960208 | 0.81 | CYP1A1 (0.50) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL7315806 | 0.81 | CYP1A1 (0.50) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL5187508 | 0.80 | CYP1A2 (0.46) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018053267-A1 | INHIBITORS OF THE MENIN-MLL INTERACTION | VITAE PHARMACEUTICALS, INC. (US) | 2018-03-22 | — | — | WO | disclosed |
| EP-2611300-B1 | SUBSTITUTED ANNELATED DIHYDROPYRIMIDINONE COMPOUNDS | BAYER IP GMBH (DE) | 2016-04-06 | — | — | EP | disclosed |
| WO-2012028578-A1 | SUBSTITUTED FUSED PYRIMIDINONES AND DIHYDROPYRIMIDINONES | BAYER CROPSCIENCE AG (DE) | 2012-03-08 | — | — | WO | disclosed |