Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.34 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.34 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL18896261 | 0.81 | ALDH1A1 (0.52) | NOS3NOS1NOS2MAPK1ALDH1A1 | |
| SCHEMBL18732236 | 0.79 | NPC1 (0.35) | KMT2A | |
| SCHEMBL18731843 | 0.79 | LMNA (0.35) | — | |
| SCHEMBL14793355 | 0.75 | NOS3 (0.39) | NOS3NOS1NOS2MAPK1ALDH1A1 | |
| SCHEMBL10204879 | 0.74 | TACR1 (0.42) | NOS3NOS1NOS2MAPK1ALDH1A1 | |
| SCHEMBL18433812 | 0.74 | KDM1A (0.42) | KMT2APOLBALDH1A1 | |
| SCHEMBL14793387 | 0.73 | CYP19A1 (0.46) | NOS3NOS1NOS2MAPK1ALDH1A1 | |
| SCHEMBL18433896 | 0.72 | NOS3 (0.37) | KMT2APOLBNOS3NOS1NOS2 | |
| SCHEMBL16338591 | 0.69 | NOS3 (0.40) | POLBNOS3NOS1NOS2MAPK1 | |
| SCHEMBL14785308 | 0.68 | NOS3 (0.36) | KMT2ANOS3NOS1NOS2MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2920153-B1 | 4-(ORTHO)-FLUOROPHENYL-5-FLUOROPYRIMIDIN-2-YL AMINES CONTAINING A SULFOXIMINE GROUP | Bayer Pharma AG (DE) | 2017-02-01 | — | — | EP | disclosed |