Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 12/20 | 0.74 |
| ▸ | FABP1 | P07148 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6638828 | 0.86 | F2 (0.58) | F2FABP1ALDH1A1TP53HTT | |
| SCHEMBL6639365 | 0.85 | F2 (0.68) | F2ALDH1A1PKM | |
| Hydrochloric Acid SCHEMBL8032926 | 0.84 | F2 (0.98) | F2ALDH1A1PKMST14BRD4 | |
| SCHEMBL6635570 | 0.83 | F2 (0.79) | F2ALDH1A1PKMST14BRD4 | |
| SCHEMBL6636479 | 0.81 | F2 (0.64) | F2FABP1ALDH1A1ST14 | |
| Hydrochloric Acid SCHEMBL8031754 | 0.80 | F2 (0.75) | F2ALDH1A1GAAPKMST14 | |
| SCHEMBL6640826 | 0.80 | F2 (0.63) | F2FABP1ALDH1A1ST14 | |
| SCHEMBL6637955 | 0.80 | F2 (0.62) | F2FABP1ALDH1A1TP53HTT | |
| SCHEMBL6638878 | 0.79 | F2 (0.78) | F2ALDH1A1PKMST14BRD4 | |
| SCHEMBL6637221 | 0.79 | F2 (0.61) | F2FABP1ALDH1A1ST14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1100795-B1 | DISUBSTITUTED BICYCLIC HETEROCYCLES HAVING, IN PARTICULAR, A THROMBIN INHIBITIVE EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-06-09 | — | — | EP | disclosed |
| US-6121308-A | INDOLE AND BENZIMIDAZOLE ANTITHROMBOTIC COMPOUNDS, SUCH AS 1-METHYL-2-(N-(4-AMIDINOPHENYL)-AMINOMETHYL)-5-(N-(HYDROXYCARBONYLMETHYL) -QUINOLINE-8-SULPHONYLAMINO)-INDOLE | BOEHRINGER INGELHEIM KG (DE) | 2000-09-19 | — | — | US | disclosed |