Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.54 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.50 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.50 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.50 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.50 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.50 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 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 | |
|---|---|---|---|---|
| SCHEMBL11835115 | 0.86 | LMNA (0.56) | HDAC1HDAC6GRIN2DGRIN3BGRIN1 | |
| SCHEMBL14694148 | 0.85 | ALDH1A1 (0.51) | HDAC1HDAC6GRIN2DGRIN3BGRIN1 | |
| SCHEMBL28129354 | 0.80 | GRIN2D (0.44) | HDAC1HDAC6GRIN2DGRIN3BGRIN1 | |
| SCHEMBL574486 | 0.77 | LMNA (0.61) | HDAC1HDAC6ALDH1A1PKMKMT2A | |
| SCHEMBL7320181 | 0.75 | NPC1 (0.56) | HDAC1HDAC6ALDH1A1KMT2AMGLL | |
| SCHEMBL3662061 | 0.74 | LMNA (0.58) | HDAC1HDAC6ALDH1A1PKMKMT2A | |
| SCHEMBL13911255 | 0.73 | HDAC1 (0.54) | HDAC1HDAC6ALDH1A1PKMKMT2A | |
| SCHEMBL7087197 | 0.73 | HDAC1 (0.53) | HDAC1HDAC6GRIN2DGRIN3BGRIN1 | |
| SCHEMBL4827830 | 0.73 | ALOX5 (0.43) | HDAC1HDAC6GRIN2DGRIN3BGRIN1 | |
| SCHEMBL6310778 | 0.72 | LMNA (0.47) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B |
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-3954995-A | Mono-and disubstituted hydroxyguanidines in the treatment of depression | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-05-04 | — | — | US | disclosed |