Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.44 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.44 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.44 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29425701 | 1.00 | KDM4E (0.50) | KDM4EHDAC1HDAC6SMN1; SMN2HSD17B10 | |
| SCHEMBL28711559 | 0.84 | NPC1 (0.64) | HDAC1HDAC6SMN1; SMN2HSD17B10NPC1 | |
| SCHEMBL29425666 | 0.83 | HDAC1 (0.53) | HDAC1HDAC6NPC1RAB9AFFAR1 | |
| SCHEMBL29425658 | 0.83 | HDAC1 (0.50) | HDAC1HDAC6NPC1RAB9AMAOB | |
| SCHEMBL28936752 | 0.83 | HDAC1 (0.53) | HDAC1HDAC6NPC1RAB9AFFAR1 | |
| SCHEMBL28706582 | 0.83 | HDAC1 (0.50) | HDAC1HDAC6NPC1RAB9AMAOB | |
| SCHEMBL28713425 | 0.82 | NPC1 (0.61) | HDAC1HDAC6SMN1; SMN2NPC1RAB9A | |
| SCHEMBL28715742 | 0.80 | GAA (0.50) | KDM4EHDAC1HDAC6SMN1; SMN2KMT2A | |
| SCHEMBL28711502 | 0.78 | CYP1A2 (0.49) | KDM4EHDAC1HDAC6SMN1; SMN2NPC1 | |
| SCHEMBL28700880 | 0.77 | NPC1 (0.48) | KDM4EHDAC1HDAC6NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-114213307-A | Preparation method of N-alkyl substituted pyrrolidone compound | 河南农业大学 | 2022-03-22 | — | — | CN | disclosed |