Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 11/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 11/20 | 0.74 |
| ▸ | RAB9A | P51151 | 8/20 | 0.74 |
| ▸ | NPC1 | O15118 | 7/20 | 0.74 |
| ▸ | MAPT | P10636 | 6/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.74 |
| ▸ | HTT | P42858 | 3/20 | 0.74 |
| ▸ | STAT3 | P40763 | 1/20 | 0.74 |
| ▸ | KDM4A | O75164 | 2/20 | 0.55 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.55 |
| ▸ | BCHE | P06276 | 2/20 | 0.54 |
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.52 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.52 |
| ▸ | GFER | P55789 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL7024146 | 0.99 | MEN1 (0.77) | MEN1KMT2ARAB9ANPC1MAPT | |
| Iodide SCHEMBL7024143 | 0.99 | MEN1 (0.77) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL10104070 | 0.88 | MEN1 (0.63) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL10266825 | 0.87 | MEN1 (0.58) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL3870022 | 0.87 | MEN1 (0.97) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL3385183 | 0.87 | MEN1 (0.97) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL10843581 | 0.86 | MEN1 (0.56) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL10842849 | 0.86 | MEN1 (0.56) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL10842845 | 0.86 | MEN1 (0.56) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL10843575 | 0.86 | MEN1 (0.56) | MEN1KMT2ARAB9ANPC1MAPT |
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-20050255538-A1 | Methods for screening for AcrAB efflux pump inhibitors | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2005-11-17 | — | — | US | disclosed |