Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL3372127 | 0.92 | L3MBTL1 (0.52) | HDAC8CYP3A4CYP2C9KMT2AMEN1 | |
| SCHEMBL11861822 | 0.86 | KMT2A (0.49) | CYP3A4CYP2C9KMT2AMEN1CYP1A2 | |
| SCHEMBL11856270 | 0.85 | CYP3A4 (0.48) | HDAC8CYP3A4CYP2C9KMT2AMEN1 | |
| SCHEMBL6005346 | 0.84 | HDAC8 (0.54) | HDAC8CYP3A4CYP2C9KMT2AMEN1 | |
| SCHEMBL11857190 | 0.84 | CYP3A4 (0.49) | HDAC8CYP3A4CYP2C9KMT2AMEN1 | |
| SCHEMBL3371105 | 0.80 | ESR1 (0.63) | KMT2ACYP1A2CYP2D6CYP2C19L3MBTL1 | |
| SCHEMBL11850785 | 0.80 | PPARG (0.44) | HDAC8CYP3A4CYP2C9HTTALDH1A1 | |
| SCHEMBL22394846 | 0.80 | CHRM1 (0.52) | KMT2AMEN1L3MBTL1MAPK1HTT | |
| SCHEMBL11857227 | 0.80 | CYP3A4 (0.66) | HDAC8CYP3A4CYP2C9KMT2AMEN1 | |
| SCHEMBL17513540 | 0.79 | HDAC8 (0.47) | HDAC8CYP3A4CYP2C9KMT2AMEN1 |
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-3991201-A | 1-(β-Aryl-β-R-ethyl)imidazoles as antimicrobial agents | JANSSEN PHARMACEUTICA N.V. (BE) | 1976-11-09 | — | — | US | disclosed |