Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | MEN1 | O00255 | 4/20 | 0.61 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.49 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL26604260 | 1.00 | KMT2A (0.61) | KMT2AMEN1THRBEPHX2CYP2C9 | |
| SCHEMBL4418666 | 0.85 | KMT2A (0.66) | KMT2AMEN1THRBEPHX2CYP2C9 | |
| SCHEMBL8722504 | 0.84 | KMT2A (0.69) | KMT2AMEN1THRBEPHX2CYP2C9 | |
| SCHEMBL28115750 | 0.84 | KMT2A (0.69) | KMT2AMEN1THRBEPHX2CYP2C9 | |
| SCHEMBL29535065 | 0.84 | KMT2A (0.56) | KMT2AMEN1THRBEPHX2CYP2C9 | |
| SCHEMBL26644726 | 0.84 | KMT2A (0.56) | KMT2AMEN1THRBEPHX2CYP2C9 | |
| SCHEMBL9134968 | 0.84 | NPC1 (0.58) | KMT2AEPHX2NPC1SMN1; SMN2RAB9A | |
| SCHEMBL9135196 | 0.84 | NPC1 (0.58) | KMT2AEPHX2NPC1SMN1; SMN2RAB9A | |
| SCHEMBL8049753 | 0.84 | NPC1 (0.58) | KMT2AEPHX2NPC1SMN1; SMN2RAB9A | |
| SCHEMBL2319510 | 0.84 | NPC1 (0.58) | KMT2AEPHX2NPC1SMN1; SMN2RAB9A |
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-11802299-B2 | Enzyme-catalyzed method for synthesizing (2S, 3R)-2-substituted aminomethyl-3-hydroxybutyrate | FUDAN UNIVERSITY (CN) | 2023-10-31 | — | — | US | disclosed |