Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.57 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | GSK3A | P49840 | 3/20 | 0.48 |
| ▸ | AURKA | O14965 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 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 | |
|---|---|---|---|---|
| SCHEMBL11834671 | 0.89 | GSK3B (0.65) | GSK3BPIN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL28759693 | 0.79 | GSK3B (0.57) | GSK3BPIN1MAPTMAPK1L3MBTL1 | |
| SCHEMBL11838370 | 0.78 | GSK3B (0.53) | GSK3BPIN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL10814332 | 0.78 | GSK3B (0.56) | GSK3BPIN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL29695661 | 0.76 | GSK3B (0.61) | GSK3BPIN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL597893 | 0.74 | TDP1 (0.50) | MAPTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1600402 | 0.74 | PIN1 (0.65) | GSK3BPIN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL2572184 | 0.74 | GSK3B (0.58) | GSK3BPIN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL10810171 | 0.74 | GSK3B (0.58) | GSK3BPIN1MAPTCYP1A2CYP3A4 | |
| SCHEMBL11197620 | 0.74 | PIN1 (0.50) | GSK3BPIN1MAPTCYP1A2CYP3A4 |
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-3943125-A | Substituted tetraamino heterocyclic compounds, useful in the preparation of substituted polybenzimidazoles and poly-imidazopyrrolones | HORIZONS INCORPORATED, A DIVISION OF HORIZONS RESEARCH INCORPORATED (US) | 1976-03-09 | — | — | US | disclosed |