Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | RORC | P51449 | 2/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6284373 | 0.85 | KMT2A (0.48) | MEN1KMT2ARORCALDH1A1CYP3A4 | |
| SCHEMBL6280465 | 0.78 | ALDH1A1 (0.43) | MEN1KMT2AACHETDP1EPHX2 | |
| SCHEMBL6284400 | 0.78 | KDM4E (0.45) | ACHERORCEPHX2DRD2DRD4 | |
| SCHEMBL6285053 | 0.72 | ACHE (0.40) | MEN1KMT2AACHEEPHX2DRD2 | |
| SCHEMBL6285059 | 0.72 | ACHE (0.40) | MEN1KMT2AACHEEPHX2DRD2 | |
| SCHEMBL6285055 | 0.72 | ACHE (0.40) | MEN1KMT2AACHEEPHX2DRD2 | |
| SCHEMBL6289025 | 0.71 | ACHE (0.42) | ACHEEPHX2DRD2DRD4BRD4 | |
| SCHEMBL6289026 | 0.71 | ACHE (0.42) | ACHEEPHX2DRD2DRD4BRD4 | |
| SCHEMBL6286303 | 0.71 | CALCRL (0.38) | MEN1KMT2AACHEDRD2DRD4 | |
| SCHEMBL10672127 | 0.68 | ACHE (0.62) | MEN1KMT2AACHEEPHX2BRD4 |
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-6927294-B1 | Nitrogen-containing heterocycles | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2005-08-09 | — | — | US | disclosed |