Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.68 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | CNR1 | P21554 | 2/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL25745961 | 0.82 | LMNA (0.48) | NAMPTHDAC6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3707614 | 0.81 | NAMPT (1.00) | NAMPT | |
| SCHEMBL25745964 | 0.79 | MAOB (0.45) | NAMPTHDAC1HDAC3HDAC8HDAC4 | |
| SCHEMBL3703523 | 0.77 | NAMPT (0.87) | NAMPTNPC1RAB9A | |
| SCHEMBL937958 | 0.76 | NPC1 (0.57) | NAMPTHIF1ANPC1RAB9AEPHX2 | |
| SCHEMBL25745892 | 0.75 | NAMPT (0.41) | NAMPTHDAC1HDAC3HDAC8HDAC4 | |
| SCHEMBL11390531 | 0.74 | ASPH (0.62) | NAMPTHIF1ANPC1RAB9AHDAC1 | |
| SCHEMBL1953254 | 0.73 | L3MBTL1 (0.68) | NPC1RAB9ACNR1EPHX2KDM4E | |
| SCHEMBL25745949 | 0.73 | KIT (0.53) | NAMPTNPC1RAB9AHDAC6 | |
| SCHEMBL25745885 | 0.73 | NAMPT (0.48) | NAMPTNPC1RAB9AHDAC1HDAC3 |
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-3781554-B1 | 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY | THOMAS HELLEDAYS STIFTELSE FOER MEDICINSK FORSKNING (SE) | 2023-06-28 | — | — | EP | disclosed |