Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.63 |
| ▸ | DHODH | Q02127 | 5/20 | 0.60 |
| ▸ | GAA | P10253 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL19339180 | 1.00 | CYP1A2 (0.63) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL18118628 | 0.89 | DHODH (0.77) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL395324 | 0.85 | DHODH (0.77) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL18854079 | 0.84 | DHODH (0.67) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL15936568 | 0.83 | SMN1; SMN2 (0.59) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL15936570 | 0.83 | DHODH (0.68) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL7602247 | 0.83 | CYP1A2 (0.62) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL6730848 | 0.83 | CYP1A2 (0.62) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL12285267 | 0.83 | DHODH (0.68) | CYP1A2CYP2C19DHODHGAAMAPT | |
| SCHEMBL1733506 | 0.83 | DHODH (0.68) | CYP1A2CYP2C19DHODHGAAMAPT |
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-5523358-A | REACTING POLYOLEFIN WITH ETHYLENICALLY UNSATURATED COMPOUND IN THE PRESENCE OF FREE RADICAL INITIATOR | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1996-06-04 | — | — | US | claimed |