Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KCNK2 | O95069 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 3/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | HBB | P68871 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8699677 | 0.77 | RARA (0.44) | GABRA1GABRB2MAPTKMT2ATP53 | |
| SCHEMBL7946236 | 0.73 | RARB (0.37) | GABRA1GABRB2HSPA9 | |
| SCHEMBL17771804 | 0.73 | SIGMAR1 (0.38) | GABRA1GABRB2MAPTKMT2ATP53 | |
| SCHEMBL2224319 | 0.69 | KDM1A (0.35) | BACE1CTSDPDE4BKDM1A | |
| SCHEMBL5735661 | 0.69 | GABRA1 (0.38) | GABRA1GABRB2MAPTKMT2ATP53 | |
| SCHEMBL5736680 | 0.69 | GABRA1 (0.38) | GABRA1GABRB2MAPTKMT2ATP53 | |
| SCHEMBL21750798 | 0.68 | GABRA1 (0.42) | GABRA1GABRB2MAPTKMT2AKCNK2 | |
| SCHEMBL5736954 | 0.68 | HDAC1 (0.47) | GABRA1GABRB2MAPTKMT2ATP53 | |
| SCHEMBL24806898 | 0.67 | BACE1 (0.34) | BACE1CTSDPDE4BKDM1ABRD4 | |
| SCHEMBL9143502 | 0.67 | GABRA1 (0.38) | GABRA1GABRB2KMT2APDE4BMEN1 |
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-6252090-B1 | Compounds having activity as inhibitors of cytochrome P450RAI | ALLERGAN SALES, INC. | 2001-06-26 | — | — | US | disclosed |