Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | CA6 | P23280 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 4/20 | 0.46 |
| ▸ | ABL1 | P00519 | 3/20 | 0.46 |
| ▸ | ABL2 | P42684 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18702684 | 0.85 | MEN1 (0.54) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL4119819 | 0.80 | TDP1 (0.48) | KMT2ACA12CA1CA2CA9 | |
| SCHEMBL8496744 | 0.78 | KMT2A (0.76) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL8623279 | 0.77 | TDP1 (0.50) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL952515 | 0.77 | KEAP1 (0.45) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL4538720 | 0.77 | PLCG1 (0.45) | CA12CA1CA2CA9CA14 | |
| Hydrochloric Acid SCHEMBL7053221 | 0.77 | KMT2A (0.73) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL7190628 | 0.75 | MEN1 (0.67) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL20526985 | 0.73 | NR1I2 (0.38) | KMT2AMEN1CA1CA2CA9 | |
| SCHEMBL18702916 | 0.73 | CA2 (0.50) | CA12CA1CA2CA9CA14 |
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-2008118758-A1 | INHIBITORS OF ION CHANNELS | ICAGEN, INC. (GB) | 2008-10-02 | — | — | WO | disclosed |