Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.45 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2668792 | 0.78 | SLC40A1 (0.55) | MEN1KMT2AALDH1A1 | |
| SCHEMBL4282939 | 0.77 | DAO (0.53) | CYP2A6HRH4HDAC3HDAC1DAO | |
| SCHEMBL27923266 | 0.75 | CYP2A6 (0.53) | CYP2A6MEN1KMT2AALDH1A1RAB9A | |
| SCHEMBL5366835 | 0.74 | DAO (0.53) | CYP2A6HRH4KDM4EALDH1A1HPGD | |
| SCHEMBL29955749 | 0.74 | CYP2A6 (0.52) | CYP2A6HRH4PIM1PIM3KDM4E | |
| SCHEMBL8029916 | 0.74 | HRH4 (0.48) | HRH4SMN1; SMN2KDM4EMEN1KMT2A | |
| SCHEMBL27849723 | 0.74 | CYP2A6 (0.52) | CYP2A6HRH4PIM1PIM3KDM4E | |
| SCHEMBL6818942 | 0.74 | CYP2A6 (0.52) | CYP2A6HRH4KDM4EMEN1KMT2A | |
| SCHEMBL20840621 | 0.74 | DAO (0.53) | CYP2A6HRH4KDM4EMEN1KMT2A | |
| SCHEMBL1145047 | 0.72 | HRH4 (0.60) | HRH4SMN1; SMN2KDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |