Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | TGM2 | P21980 | 3/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ACACB | O00763 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9694817 | 0.81 | TAAR1 (0.69) | RAB9ANPC1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL11949543 | 0.81 | RAB9A (0.79) | RAB9ANPC1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL880676 | 0.81 | RAB9A (0.79) | RAB9ANPC1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL28630813 | 0.81 | KMT2A (0.60) | NPC1SMN1; SMN2KMT2AMEN1TP53 | |
| SCHEMBL28617369 | 0.81 | KMT2A (0.60) | NPC1SMN1; SMN2KMT2AMEN1TP53 | |
| SCHEMBL28619644 | 0.81 | KMT2A (0.60) | NPC1SMN1; SMN2KMT2AMEN1TP53 | |
| SCHEMBL4103656 | 0.80 | RAB9A (0.74) | RAB9ANPC1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL28617460 | 0.79 | HDAC1 (0.63) | NPC1KMT2AMEN1TP53TGM2 | |
| SCHEMBL28616232 | 0.78 | HDAC6 (0.59) | RAB9ATP53TGM2HPGDKDM4E | |
| SCHEMBL23099741 | 0.77 | NPC1 (0.74) | RAB9ANPC1SMN1; SMN2KMT2AMEN1 |
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-109438279-B | Small molecule compound for overcoming EGFR drug-resistant mutation and preparation method and application thereof | 四川大学 | 2021-08-31 | — | — | CN | disclosed |