Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.67 |
| ▸ | EGFR | P00533 | 2/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.59 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.59 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.59 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.59 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.59 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.59 |
| ▸ | MMP1 | P03956 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | MMP2 | P08253 | 1/20 | 0.55 |
| ▸ | MMP9 | P14780 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL29830593 | 1.00 | KMT2A (0.67) | KMT2AEGFRRAB9ANPC1HDAC3 | |
| SCHEMBL29992174 | 0.89 | RAB9A (0.57) | KMT2AEGFRRAB9ANPC1MMP1 | |
| SCHEMBL22882086 | 0.89 | RAB9A (0.57) | KMT2AEGFRRAB9ANPC1MMP1 | |
| SCHEMBL31344550 | 0.85 | EGFR (0.48) | KMT2AEGFRHDAC3HDAC4HDAC1 | |
| SCHEMBL3208177 | 0.84 | KMT2A (0.93) | KMT2AEGFRRAB9ANPC1HDAC3 | |
| SCHEMBL31344552 | 0.84 | EGFR (0.50) | KMT2AEGFRRAB9ANPC1HDAC3 | |
| SCHEMBL27218420 | 0.84 | KMT2A (0.51) | KMT2AEGFRRAB9ANPC1HDAC3 | |
| SCHEMBL27218419 | 0.84 | KMT2A (0.51) | KMT2AEGFRRAB9ANPC1HDAC3 | |
| SCHEMBL29992177 | 0.84 | AKR1B10 (0.51) | KMT2AEGFRRAB9ASMN1; SMN2LMNA | |
| SCHEMBL22882087 | 0.84 | AKR1B10 (0.51) | KMT2AEGFRRAB9ASMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021063942-A1 | IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2021-04-08 | — | — | WO | disclosed |