Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | TERT | O14746 | 1/20 | 0.45 |
| ▸ | S100B | P04271 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.41 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1574035 | 0.91 | ALDH1A1 (0.71) | ALDH1A1CYP3A4TSHRTERTS100B | |
| SCHEMBL8643876 | 0.86 | ALDH1A1 (0.85) | ALDH1A1CYP3A4TSHRTERTS100B | |
| SCHEMBL8064931 | 0.84 | ALDH1A1 (0.59) | ALDH1A1CYP3A4TSHRTERTS100B | |
| SCHEMBL4391221 | 0.83 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRTERTKMT2A | |
| SCHEMBL14283564 | 0.82 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TSHRTERTS100B | |
| SCHEMBL12470976 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRS100BKMT2A | |
| Diethylaniline SCHEMBL9174326 | 0.81 | TSHR (0.47) | ALDH1A1CYP3A4TSHRKMT2AMEN1 | |
| SCHEMBL14283535 | 0.80 | ALDH1A1 (0.59) | ALDH1A1CYP3A4TSHRTERTS100B | |
| Diethylaniline SCHEMBL6907129 | 0.79 | TSHR (0.59) | ALDH1A1CYP3A4TSHRKMT2AMEN1 | |
| SCHEMBL9066719 | 0.78 | TERT (0.57) | ALDH1A1CYP3A4TSHRTERTS100B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996009173-A1 | NOVEL COLORANT FOR USE IN BUSINESS RECORDING | INDIANA UNIVERSITY FOUNDATION (US) | 1996-03-28 | — | — | WO | disclosed |
| US-5453522-A | Colorant for use in business recording | INDIANA UNIVERSITY FOUNDATION (US) | 1995-09-26 | — | — | US | disclosed |