Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | GAA | P10253 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | UBE2M | P61081 | 1/20 | 0.55 |
| ▸ | DCUN1D1 | Q96GG9 | 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 | |
|---|---|---|---|---|
| SCHEMBL12764173 | 0.89 | MEN1 (0.69) | ALDH1A1GAAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL10197815 | 0.89 | MAPT (0.58) | ALDH1A1GAAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL12764175 | 0.86 | RAB9A (0.74) | ALDH1A1GAAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL24060059 | 0.84 | RAB9A (0.72) | ALDH1A1GAAMEN1KMT2ALMNA | |
| SCHEMBL10195757 | 0.83 | MEN1 (0.59) | ALDH1A1GAAMEN1KMT2ARAB9A | |
| SCHEMBL18657984 | 0.82 | UBE2M (0.71) | ALDH1A1MEN1KMT2ASMN1; SMN2MAPT | |
| SCHEMBL18657980 | 0.81 | POLB (0.78) | ALDH1A1GAAKMT2ASMN1; SMN2MAPT | |
| SCHEMBL16234289 | 0.79 | EPHX2 (0.80) | — | |
| SCHEMBL23245968 | 0.76 | UBE2M (0.56) | ALDH1A1GAAMAPTLMNAPOLB | |
| SCHEMBL12558144 | 0.75 | NPC1 (0.58) | MEN1KMT2ASMN1; SMN2MAPTLMNA |
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-2012006104-A2 | COMPOUNDS AND METHODS FOR TREATING TUBERCULOSIS INFECTION | Academia Sinica, Taiwan (TW) | 2012-01-12 | — | — | WO | disclosed |