Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TLR4 | O00206 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8640867 | 1.00 | CYP1A2 (0.50) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL16730084 | 1.00 | CYP1A2 (0.50) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL9356259 | 1.00 | CYP1A2 (0.50) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL9139886 | 1.00 | CYP1A2 (0.50) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL2853523 | 1.00 | CYP1A2 (0.50) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL11082717 | 1.00 | CYP1A2 (0.50) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL6736225 | 1.00 | CYP1A2 (0.50) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL9013411 | 0.98 | CYP1A2 (0.49) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL9013646 | 0.98 | CYP1A2 (0.49) | CYP1A2EPHX1MEN1KMT2ATLR4 | |
| SCHEMBL9013415 | 0.98 | CYP1A2 (0.49) | CYP1A2EPHX1MEN1KMT2ATLR4 |
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-4555537-A | IMIDAZOLINE DERIVATIVES | AMERICAN CYANAMID COMPANY (US) | 1985-11-26 | — | — | US | disclosed |